SCHEMBL1294768

SCHEMBL1294768

Cc1cccc2[nH]cc(C(C)n3c(=O)n([C@H](CC(=O)O)c4ccccc4)c4ccncc43)c12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 14/20 0.40
▸ SLC6A2 P23975 1/20 0.34
▸ MGAM O43451 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ CYP1A2 P05177 2/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ GABRB2 P47870 1/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 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
SCHEMBL1294774 1.00 CMA1 (0.40) CMA1SLC6A2MGAMGAASI
SCHEMBL1294649 0.87 MGAM (0.34) CMA1SLC6A2MGAMGAASI
SCHEMBL1294646 0.87 MGAM (0.34) CMA1SLC6A2MGAMGAASI
SCHEMBL2312681 0.87 SLC6A2 (0.36) CMA1SLC6A2MGAMGAASI
SCHEMBL2314034 0.87 GAA (0.40) CMA1SLC6A2MGAMGAASI
SCHEMBL1294671 0.86 CMA1 (0.43) CMA1
SCHEMBL1294666 0.86 CMA1 (0.43) CMA1
SCHEMBL2311580 0.85 CTSA (0.36) CMA1SLC6A2MGAMGAASI
SCHEMBL2314344 0.85 GAA (0.39) CMA1SLC6A2MGAMGAASI
SCHEMBL2314336 0.85 GAA (0.39) CMA1SLC6A2MGAMGAASI

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-9062056-B2 Aza-benzimidazolone Chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-06-23 — — US disclosed
EP-2364313-B1 AZA-BENZIMIDAZOLONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2014-01-08 — — EP disclosed
US-20110269780-A1 AZA-BENZIMIDAZOLONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 — — US disclosed
EP-2364313-A1 AZA-BENZIMIDAZOLONE CHYMASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2011-09-14 — — EP disclosed
WO-2010030500-A1 AZA-BENZIMIDAZOLONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-18 — — 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-20110269780-A1 AZA-BENZIMIDAZOLONE CHYMASE INHIBITORS CMA1, CPA3, SERPINB1 CMA1 1/4885SLC6A2 4245/4885MGAM 369/4885

“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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