SCHEMBL2308876

SCHEMBL2308876

Cc1cc(C)c2c(Cn3c(=O)n([C@H](CC(=O)O)c4ccccc4)c4cc(C(=O)NS(C)(=O)=O)ccc43)cn(C)c2c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 14/20 0.49
HTR1D P28221 1/20 0.49
OPRK1 P41145 1/20 0.49
CTSG P08311 1/20 0.42
SCN9A Q15858 6/20 0.41
SCN2B O60939 1/20 0.39
SCN1A P35498 1/20 0.39
SCN1B Q07699 1/20 0.39
SCN5A Q14524 1/20 0.39

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
SCHEMBL2312835 0.92 CMA1 (0.45) CMA1HTR1DOPRK1CTSGSCN9A
SCHEMBL2313584 0.91 CMA1 (0.52) CMA1HTR1DOPRK1CTSG
SCHEMBL2314768 0.88 CMA1 (0.49) CMA1HTR1DOPRK1CTSG
SCHEMBL2312735 0.87 CMA1 (0.55) CMA1HTR1DOPRK1CTSG
SCHEMBL2311424 0.87 CMA1 (0.55) CMA1HTR1DOPRK1CTSGSCN9A
SCHEMBL2313594 0.87 CMA1 (0.48) CMA1HTR1DOPRK1CTSG
SCHEMBL2833557 0.85 CMA1 (0.61) CMA1HTR1DOPRK1CTSG
SCHEMBL2313638 0.85 CMA1 (0.61) CMA1HTR1DOPRK1CTSG
SCHEMBL2314030 0.85 CMA1 (0.52) CMA1HTR1DOPRK1CTSG
SCHEMBL2311889 0.84 CMA1 (0.55) CMA1HTR1DOPRK1CTSG

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 8 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
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 CMA1 1/4885HTR1D 2802/4885OPRK1 4079/4885

“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.