SCHEMBL6760580

SCHEMBL6760580

CCc1c(C)nn(C)c1C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 3/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
TP53 P04637 2/20 0.38
RAB9A P51151 5/20 0.37
NPC1 O15118 3/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 3/20 0.36
NR2F2 P24468 2/20 0.35
GALR3 O60755 1/20 0.35
MPO P05164 1/20 0.34

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
SCHEMBL12844283 0.81 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1KDM4ELMNATP53
SCHEMBL23978357 0.79 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
SCHEMBL15896828 0.78 GAA (0.47) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
SCHEMBL7993567 0.78 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
SCHEMBL5898267 0.78 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
SCHEMBL6744408 0.78 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
SCHEMBL5898273 0.78 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KDM4ELMNATP53
SCHEMBL762264 0.78 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
Hydrochloric Acid SCHEMBL14696281 0.76 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1KDM4ELMNAHTT
SCHEMBL805436 0.76 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1LMNAHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1085974-A None JP disclosed
WO-2023220741-A1 ALPHA 4 BETA 7 INTEGRIN MODULATORS AND USES THEREOF DICE MOLECULES SV, INC. (US) 2023-11-16 WO disclosed
EP-3774775-B1 4-OXO-3,4-DIHYDROQUINAZOLINE COMPOUNDS AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV HEALTHCARE UK NO 5 LTD (GB) 2023-10-11 EP disclosed
US-20230158024-A1 CD38 INHIBITORS Astellas Engineered Small Molecules US, Incorporated 2023-05-25 US disclosed
US-20220280644-A1 \"TRPswitch\" - A STEP FUNCTION CHEMO-OPTOGENETIC LIGAND NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-09-08 US disclosed
US-20220220111-A1 1,8-NAPHTHYRIDINONE COMPOUNDS AND USES THEREOF NUVATION BIO OPERATING COMPANY INC (US) 2022-07-14 US disclosed
US-20220119367-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2022-04-21 US disclosed
US-11254670-B2 1,8-naphthyridinone compounds and uses thereof NUVATION BIO INC. (US) 2022-02-22 US disclosed
WO-2021219731-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2021-11-04 WO disclosed
EP-3589630-B1 CYCLIC SULFAMIDE COMPOUNDS AND METHODS OF USING SAME ASSEMBLY BIOSCIENCES INC (US) 2021-07-07 EP disclosed
WO-2009050236-A1 NOVEL PIPERAZINO-DIHYDROTHIENOPYRIMIDINE DERIVATIVES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-23 WO disclosed
US-20080312435-A1 Imine Compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-18 US disclosed
US-20080153778-A1 N-aryl pyrazole compounds, compositions, and methods for their use AMGEN INC. 2008-06-26 US disclosed
US-20080153778-A1 N-aryl pyrazole compounds, compositions, and methods for their use AMGEN INC. 2008-06-26 US disclosed
US-7365139-B2 Polymerisation catalyst BP CHEMICALS LIMITED (GB) 2008-04-29 US disclosed
WO-2008045484-A1 N-ARYL PYRAZOLE COMPOUNDS FOR USE AGAINST DIABETES AMGEN INC. (US) 2008-04-17 WO disclosed
US-20070161761-A1 Polymerisation catalyst BP CHEMICALS LIMITED 2007-07-12 US disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
US-7186500-B2 Silver halide photographic lightsensitive material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-06 US disclosed
WO-2003007959-A1 QUINOXALINE DERIVATIVES WHICH HAVE PARP INHIBITORY ACTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-01-30 WO 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-20080312435-A1 Imine Compound CNR1, CNR2, HRH4 SMN1; SMN2 1844/4885ALDH1A1 2674/4885KDM4E 3386/4885
US-20070161761-A1 Polymerisation catalyst GRM8, CHD8, CHRNA9 SMN1; SMN2 2448/4885ALDH1A1 4218/4885KDM4E 2724/4885
US-11254670-B2 1,8-naphthyridinone compounds and uses thereof NME1, ADORA2A, GPR68 SMN1; SMN2 3645/4885ALDH1A1 1543/4885KDM4E 3184/4885
US-20220220111-A1 1,8-NAPHTHYRIDINONE COMPOUNDS AND USES THEREOF NME1, ADORA2A, GPR68 SMN1; SMN2 3645/4885ALDH1A1 1543/4885KDM4E 3184/4885
US-20080153778-A1 N-aryl pyrazole compounds, compositions, and methods for their use GLP1R, GPR119, NAT1 SMN1; SMN2 2951/4885ALDH1A1 636/4885KDM4E 4209/4885
US-20220119367-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS ADORA2A, ADORA3, ADORA1 SMN1; SMN2 4476/4885ALDH1A1 2100/4885KDM4E 4200/4885
US-20220280644-A1 \"TRPswitch\" - A STEP FUNCTION CHEMO-OPTOGENETIC LIGAND TRPA1, TRPC3, TRPV1 SMN1; SMN2 2751/4885ALDH1A1 1570/4885KDM4E 4160/4885
US-20230158024-A1 CD38 INHIBITORS CD38, NQO1, NDUFAB1 SMN1; SMN2 297/4885ALDH1A1 146/4885KDM4E 1196/4885

“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.