SCHEMBL2313859

SCHEMBL2313859

CCCC(CC(=O)O)n1c(=O)n([C@@H](C)c2c[nH]c3cc(C)cc(C)c23)c2ccc(C(=O)NC)cc21

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 13/20 0.34
CTSG P08311 1/20 0.33
HTR1D P28221 1/20 0.32
OPRK1 P41145 1/20 0.32
MAPK10 P53779 1/20 0.31
HPD P32754 1/20 0.31

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
SCHEMBL2313864 1.00 CMA1 (0.34) CMA1CTSGHTR1DOPRK1MAPK10
SCHEMBL2311426 0.91 CMA1 (0.33) CMA1CTSGHTR1DOPRK1HPD
SCHEMBL2311937 0.87 CMA1 (0.33) CMA1CTSGHTR1DOPRK1
SCHEMBL2313587 0.86 SLC6A2 (0.33) CMA1HTR1DOPRK1MAPK10
SCHEMBL2313591 0.86 SLC6A2 (0.33) CMA1HTR1DOPRK1MAPK10
SCHEMBL2314485 0.85 CMA1 (0.35) CMA1CTSGHTR1DOPRK1
SCHEMBL2308199 0.85 CMA1 (0.35) CMA1CTSGHTR1DOPRK1
SCHEMBL2317170 0.83 SCN9A (0.33) HPD
SCHEMBL1294858 0.82 CMA1 (0.37) CMA1CTSGHTR1DOPRK1
SCHEMBL1294863 0.82 CMA1 (0.37) CMA1CTSGHTR1DOPRK1

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 3 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
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

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 1/4885CTSG 26/4885HTR1D 2802/4885

“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.