SCHEMBL2314943

SCHEMBL2314943

CCCC(CC(=O)OC)n1c(=O)n(Cc2cc(Br)cc3c2CC(=O)N3)c2ccccc21

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 9/20 0.83
CTSG P08311 2/20 0.83
CDK1 P06493 5/20 0.41
GSK3B P49841 6/20 0.36
CCNB2 O95067 4/20 0.36
CCNB1 P14635 4/20 0.36
CCNB3 Q8WWL7 4/20 0.36
DRD2 P14416 2/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GSK3A P49840 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL2309855 0.91 CMA1 (1.00) CMA1CTSGCDK1GSK3BCCNB2
SCHEMBL12431684 0.90 CMA1 (0.69) CMA1CTSGCDK1GSK3BCCNB2
SCHEMBL2310839 0.81 CMA1 (1.00) CMA1CTSGSMN1; SMN2
SCHEMBL8118424 0.81 CMA1 (0.54) CMA1CTSGKDM4ESMN1; SMN2MEN1
SCHEMBL8105375 0.80 CMA1 (0.62) CMA1CTSGSMN1; SMN2MEN1KMT2A
SCHEMBL2314701 0.79 CMA1 (1.00) CMA1CTSGCDK1GSK3BCCNB2
SCHEMBL12431674 0.75 CMA1 (0.48) CMA1CTSGKDM4ESMN1; SMN2MEN1
SCHEMBL13129768 0.75 CMA1 (0.49) CMA1CTSGCDK1GSK3BCCNB2
SCHEMBL8118350 0.75 CMA1 (0.49) CMA1CTSG
SCHEMBL8122292 0.75 CMA1 (0.86) CMA1CTSGCDK1GSK3BCCNB2

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 6 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
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 1/4885CTSG 26/4885CDK1 971/4885

“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.