SCHEMBL2313207

SCHEMBL2313207

CCOC(=O)C1=C(n2c(=O)[nH]c3ccccc32)CCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ MAPT P10636 5/20 0.47
▸ LMNA P02545 3/20 0.47
▸ ADORA3 P0DMS8 3/20 0.47
▸ ALDH1A1 P00352 6/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ POLB P06746 1/20 0.44
▸ CHRM2 P08172 1/20 0.43
▸ CHRM4 P08173 1/20 0.43
▸ CHRM5 P08912 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ CHRM3 P20309 1/20 0.43
▸ MAT2A P31153 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.41
▸ CYP1A2 P05177 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
SCHEMBL8110895 0.81 LMNA (0.55) MAPTLMNAALDH1A1CHRM2CHRM4
SCHEMBL2256170 0.76 SMN1; SMN2 (0.78) GAASMN1; SMN2NPC1MAPTLMNA
SCHEMBL28496776 0.74 MAT2A (0.65) GAASMN1; SMN2NPC1MAPTLMNA
SCHEMBL21467333 0.73 KDM4E (0.52) GAASMN1; SMN2NPC1MAPTADORA3
SCHEMBL348977 0.71 MEN1 (0.53) GAASMN1; SMN2NPC1MAPTLMNA
SCHEMBL6219061 0.70 CHRM2 (0.53) GAAADORA3MEN1KMT2APOLB
SCHEMBL30615534 0.68 SMN1; SMN2 (0.51) GAASMN1; SMN2NPC1MAPTADORA3
SCHEMBL21463412 0.68 SMN1; SMN2 (0.51) GAASMN1; SMN2NPC1MAPTADORA3
SCHEMBL30891925 0.67 ALDH1A1 (0.64) SMN1; SMN2MAPTLMNAALDH1A1MEN1
SCHEMBL9139429 0.67 ALDH1A1 (0.64) SMN1; SMN2MAPTLMNAALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9150556-B2 Benzimidazolone chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 — — US disclosed
US-9150556-B2 Benzimidazolone chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 — — US disclosed
US-9150556-B2 Benzimidazolone chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 — — US disclosed
EP-2152674-B1 BENZIMIDAZOLONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2011-08-03 — — EP disclosed
US-20100240702-A1 Benzimidazolone Chymase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 — — US disclosed
US-20100240702-A1 Benzimidazolone Chymase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 — — US disclosed
US-20100240702-A1 Benzimidazolone Chymase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 — — US disclosed
EP-2152674-A1 BENZIMIDAZOLONE CHYMASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2010-02-17 — — EP disclosed
WO-2008147697-A1 BENZIMIDAZOLONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-12-04 — — 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 (1 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-20100240702-A1 Benzimidazolone Chymase Inhibitors CMA1, SERPINB1, CPA3 GAA 21/4885SMN1; SMN2 1983/4885NPC1 430/4885

“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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