SCHEMBL832456

SCHEMBL832456

[c]1cccc2nc3ccccn3c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.49
ALDH1A1 P00352 5/20 0.49
GLA P06280 5/20 0.49
GAA P10253 5/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HPGD P15428 3/20 0.47
NPC1 O15118 3/20 0.47
HSD17B10 Q99714 3/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
POLB P06746 2/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
USP7 Q93009 4/20 0.37
PKM P14618 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL832455 0.75 KDM4E (0.47) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL839837 0.75 ALDH1A1 (0.62) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL23294847 0.74 KDM4E (0.46) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL7794403 0.72 KDM4E (0.49) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL15437780 0.69 SMN1; SMN2 (0.44) KDM4EALDH1A1GAASMN1; SMN2HPGD
SCHEMBL22342347 0.68 SMN1; SMN2 (0.36) KDM4EALDH1A1GAASMN1; SMN2HPGD
SCHEMBL15641745 0.67 KDM4E (0.47) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL8311753 0.67 ALDH1A1 (0.50) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL2427657 0.66 KDM4E (1.00) KDM4EALDH1A1GLAGAASMN1; SMN2
SCHEMBL5573020 0.66 PTPN1 (0.49) KDM4EALDH1A1GLAGAAHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 74 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999741-B2 Process for the synthesis of 6-((3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl)-3-(tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one CARDURION PHARMACEUTICALS, INC. (US) 2024-06-04 US disclosed
EP-3630772-B1 METHODS OF MAKING AND USING PDE9 INHIBITORS IMARA INC (US) 2023-11-01 EP disclosed
US-20230183244-A1 METHODS OF MAKING AND USING PDE9 INHIBITORS CARDURION PHARMACEUTICALS, INC. 2023-06-15 US disclosed
US-11370795-B2 Process for the synthesis of 6-[(3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl]-3-tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one Imara Inc. (US) 2022-06-28 US disclosed
US-20220185836-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF CANCERS XLINK THERAPEUTICS INC (US) 2022-06-16 US disclosed
EP-3157515-B1 PLATINUM COMPOUNDS, COMPOSITIONS, AND USES THEREOF PLACON THERAPEUTICS INC (US) 2021-05-26 EP disclosed
EP-3797768-A1 MALEIMIDE-FUNCTIONALISED PLATINUM FOR USE IN THE TREATMENT OF CANCER Placon Therapeutics, Inc. (US) 2021-03-31 EP disclosed
US-20210085684-A1 PDE9 INHIBITORS FOR TREATMENT OF PERIPHERAL DISEASES CARDURION PHARMACEUTICALS, INC. 2021-03-25 US disclosed
EP-3313392-B1 PLATINUM COMPOUNDS, COMPOSITIONS, AND USES THEREOF PLACON THERAPEUTICS INC (US) 2020-09-16 EP disclosed
US-20200157108-A1 METHODS OF MAKING AND USING PDE9 INHIBITORS CARDURION PHARMACEUTICALS, INC. 2020-05-21 US disclosed
EP-2125811-A2 N-(AMINO-HETEROARYL)-1H-PYRROLOPYRIDINE-2-CARBOXAMIDES DERIVATIVES, PREPARATION THEREOF AND THEIR USE IN THERAPY Sanofi-Aventis (FR) 2009-12-02 EP disclosed
EP-2125787-A1 DERIVATIVES OF N-(HETEROARYL)-1-HETEROARYL-1H-INDOL-2-CARBOXAMIDS, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2009-12-02 EP disclosed
WO-2009109710-A1 DERIVATIVES OF INDOLE 2-CARBOXAMIDES AND AZAINDOLE 2-CARBOXAMIDES SUBSTITUTED BY A SILANYLE GROUP, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-09-11 WO disclosed
US-20090042873-A1 TRICYCLIC N-HETEROARYL-CARBOXAMIDE DERIVATIVES CONTAINING A BENZIMIDAZOLE UNIT, METHOD FOR PREPARING SAME AND THEIR THERAPEUTIC USE SANOFI-AVENTIS (FR) 2009-02-12 US disclosed
WO-2008107544-A1 DERIVATIVES OF N-(HETEROARYL)-1-HETEROARYL-1H-INDOL-2-CARBOXAMIDS, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2008-09-12 WO disclosed
WO-2008093024-A2 N-(AMINO-HETEROARYL)-1H-PYRROLOPYRIDINE-2-CARBOXAMIDES DERIVATIVES, PREPARATION THEREOF AND THEIR USE IN THERAPY SANOFI-AVENTIS (FR) 2008-08-07 WO disclosed
US-20080044354-A1 Compounds Containing a N-Heteroaryl Moiety Linked to Fused Ring Moieties for the Inhibition of Nad(P)H Oxidases and Platelet Activation VASOPHARM GMBH (DE) 2008-02-21 US disclosed
EP-1756113-A1 COMPOUNDS CONTAINING A N-HETEROARYL MOIETY LINKED TO FUSED RING MOIETIES FOR THE INHIBITION OF NAD(P)H OXIDASES AND PLATELET ACTIVATION Vasopharm Biotech GmbH (DE) 2007-02-28 EP disclosed
WO-2005111041-A1 COMPOUNDS CONTAINING A N-HETEROARYL MOIETY LINKED TO FUSED RING MOIETIES FOR THE INHIBITION OF NAD(P)H OXIDASES AND PLATELET ACTIVATION VASOPHARM BIOTECH GMBH (DE) 2005-11-24 WO disclosed
EP-1598354-A1 Compounds containing a N-heteroaryl moiety linked to fused ring moieties for the inhibition of NAD(P)H oxidases and platelet activation Vasopharm Biotech GmbH (DE) 2005-11-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220185836-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF CANCERS TP53, VHL, KRAS KDM4E 1824/4885ALDH1A1 2098/4885GLA 3247/4885
US-20210085684-A1 PDE9 INHIBITORS FOR TREATMENT OF PERIPHERAL DISEASES PDE9A, PDE12, PDE5A KDM4E 3503/4885ALDH1A1 1037/4885GLA 904/4885
US-20200157108-A1 METHODS OF MAKING AND USING PDE9 INHIBITORS PDE9A, PDE2A, PDE3B KDM4E 1993/4885ALDH1A1 560/4885GLA 227/4885
US-20090042873-A1 TRICYCLIC N-HETEROARYL-CARBOXAMIDE DERIVATIVES CONTAINING A BENZIMIDAZOLE UNIT, METHOD FOR PREPARING SAME AND THEIR THERAPEUTIC USE CYP3A5, CYP2C8, PAICS KDM4E 1797/4885ALDH1A1 484/4885GLA 2541/4885
US-11999741-B2 Process for the synthesis of 6-((3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl)-3-(tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one CDK8, PRMT8, RPS8 KDM4E 969/4885ALDH1A1 2636/4885GLA 4010/4885
US-20230183244-A1 METHODS OF MAKING AND USING PDE9 INHIBITORS PDE9A, PDE4B, PDE12 KDM4E 2462/4885ALDH1A1 2125/4885GLA 175/4885
US-20080044354-A1 Compounds Containing a N-Heteroaryl Moiety Linked to Fused Ring Moieties for the Inhibition of Nad(P)H Oxidases and Platelet Activation NQO1, CYBB, NADK KDM4E 2395/4885ALDH1A1 284/4885GLA 1454/4885
US-11370795-B2 Process for the synthesis of 6-[(3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl]-3-tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one TYMS, TKT, TPMT KDM4E 1156/4885ALDH1A1 648/4885GLA 3152/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.