SCHEMBL2318315

SCHEMBL2318315

Cc1cccc2[nH]cc(C(C)n3c(=O)n(C4(CC(=O)O)CCCCC4)c4ccccc43)c12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSG P08311 1/20 0.32
▸ CMA1 P23946 1/20 0.32
▸ OPRM1 P35372 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ OPRL1 P41146 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ ALKBH5 Q6P6C2 1/20 0.31
▸ FTO Q9C0B1 1/20 0.31
▸ ACACB O00763 1/20 0.31
▸ ACACA Q13085 1/20 0.31
▸ HCN1 O60741 1/20 0.30
▸ GPR84 Q9NQS5 1/20 0.30
▸ C5AR1 P21730 1/20 0.30

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
SCHEMBL2314667 0.99 CTSG (0.32) CTSGCMA1KCNH2ALKBH5FTO
SCHEMBL3684589 0.92 CMA1 (0.33) CTSGCMA1KCNH2ACACBACACA
SCHEMBL3686184 0.83 ACACB (0.35) CMA1ALKBH5FTOACACBACACA
SCHEMBL3686129 0.80 NPC1 (0.31) CMA1ACACA
SCHEMBL2309891 0.78 CTSG (0.31) CTSGCMA1
SCHEMBL2311338 0.77 CMA1 (0.33) CMA1GPR84C5AR1
SCHEMBL2309500 0.76 CTSA (0.35) CTSGCMA1GPR84C5AR1
SCHEMBL2314001 0.76 CMA1 (0.39) CTSGCMA1GPR84C5AR1
SCHEMBL2311149 0.75 SLC6A2 (0.35) CTSGCMA1GPR84C5AR1
SCHEMBL2359024 0.75 C5AR1 (0.33) C5AR1

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 5 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
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 CTSG 26/4885CMA1 1/4885OPRM1 4852/4885

“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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