SCHEMBL5319954

SCHEMBL5319954

O=Cc1ccccc1Oc1cccc(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.66
▸ KMT2A Q03164 2/20 0.66
▸ GAA P10253 1/20 0.66
▸ NPSR1 Q6W5P4 1/20 0.57
▸ CYP1A2 P05177 3/20 0.54
▸ CYP2C9 P11712 3/20 0.54
▸ CYP2C19 P33261 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ SLC6A4 P31645 3/20 0.50
▸ SLC6A2 P23975 2/20 0.50
▸ SLC6A3 Q01959 2/20 0.50
▸ RHEB Q15382 3/20 0.48
▸ HTR1A P08908 1/20 0.47
▸ HTT P42858 3/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HTR2A P28223 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL23709944 0.87 SLC6A4 (0.50) LMNAKMT2AGAANPSR1CYP1A2
SCHEMBL10656577 0.81 ALDH1A1 (0.53) LMNAKMT2AGAANPSR1ALDH1A1
SCHEMBL3267772 0.81 LMNA (0.49) LMNAKMT2AGAACYP1A2CYP2C9
SCHEMBL643021 0.81 LMNA (0.72) LMNAKMT2AGAANPSR1CYP1A2
SCHEMBL15065366 0.80 ALDH1A1 (0.59) LMNAKMT2AGAACYP1A2CYP2C9
SCHEMBL8393465 0.80 LMNA (0.73) LMNAKMT2AGAANPSR1CYP1A2
SCHEMBL5321373 0.80 LMNA (0.61) LMNAKMT2AGAANPSR1CYP1A2
SCHEMBL2353958 0.80 LMNA (0.66) LMNAKMT2AGAANPSR1CYP1A2
SCHEMBL2939883 0.80 LMNA (0.66) LMNAKMT2AGAANPSR1CYP1A2
SCHEMBL95238 0.80 LMNA (1.00) LMNAKMT2AGAANPSR1CYP1A2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-24 — — US disclosed
US-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-08-05 — — US disclosed
CN-110317200-B Pyrimidinium compounds and uses thereof 东莞市东阳光农药研发有限公司 2020-09-11 — — CN disclosed
CN-110317200-A Pyrimidine compound and application thereof 东莞东阳光科研发有限公司 2019-10-11 — — CN disclosed
WO-2016019588-A1 OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE THE BROAD INSTITUTE, INC. (US) 2016-02-11 — — WO disclosed
US-20140121213-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2014-05-01 — — US disclosed
US-20140121213-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2014-05-01 — — US disclosed
US-20130023541-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED 2013-01-24 — — US disclosed
US-20130023541-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED 2013-01-24 — — US disclosed
WO-2011088201-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2011-07-21 — — WO disclosed
WO-2007095495-A2 BENZODIAZEPINE GCNF MODULATORS FOR STEM CELL MODULATION PHARMACOPEIA, INC. (US) 2007-08-23 — — WO disclosed
CN-1216052-C Anti-neurodegeneratively active 10-aminoaliphatyl-dibenz (b,f) oxepines NAVARTIS AG (CH) 2005-08-24 — — CN disclosed
EP-0726265-B1 10-Aminoaliphatyl-dibenz(b,f)oxepins with antineurodegenarative activity NOVARTIS AG (CH) 2001-07-25 — — EP disclosed
US-5780501-A ADMINISTERING TO A MAMMAL NOVARTIS CORPORATION (US) 1998-07-14 — — US disclosed
US-5780500-A Anti-neurodegeneratively active 10-aminoaliphatyl-dibenzi b,f! oxepines NOVARTIS CORPORATION (US) 1998-07-14 — — US disclosed
CN-1137039-A Anti-neurodegeneratively active 10-aminoaliphatyl-dibenz (b,f) oxepines CIBA GEIGY AG (CH) 1996-12-04 — — CN disclosed
EP-0726265-A1 10-Aminoaliphatyl-dibenz(b,f)oxepins with antineurodegenarative activity CIBA-GEIGY AG (CH) 1996-08-14 — — 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 (4 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-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF RHEB, KRAS, NRAS LMNA 4243/4885KMT2A 2481/4885GAA 1821/4885
US-20130023541-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS KCNB1, KCNB2, SCNN1B LMNA 611/4885KMT2A 2744/4885GAA 2499/4885
US-20140121213-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS KCNB1, SCNN1B, TRPV1 LMNA 816/4885KMT2A 3151/4885GAA 1691/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS LMNA 2918/4885KMT2A 3149/4885GAA 1063/4885

“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.

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