SCHEMBL2311587

SCHEMBL2311587

CCOC(=O)C[C@H](CCc1ccccc1)Nc1cc(C)ccc1N

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.46
F2 P00734 4/20 0.43
LNPEP Q9UIQ6 5/20 0.43
CTSG P08311 1/20 0.42
CTRB1 P17538 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.40
PRSS1 P07477 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 2/20 0.39
NLRP3 Q96P20 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
ERAP2 Q6P179 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ERAP1 Q9NZ08 1/20 0.38

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
SCHEMBL2311597 1.00 F10 (0.46) F10F2LNPEPCTSGCTRB1
SCHEMBL2315825 0.86 NLRP3 (0.43) LNPEPSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL2318044 0.83 MAPT (0.47) F10CTSGCTRB1SMN1; SMN2POLB
SCHEMBL2318048 0.83 MAPT (0.47) F10CTSGCTRB1SMN1; SMN2POLB
SCHEMBL19157175 0.78 NLRP3 (0.46) SMN1; SMN2MEN1KMT2ARAB9ANLRP3
SCHEMBL2312151 0.77 ALDH1A1 (0.42) F2SMN1; SMN2POLBNLRP3HDAC6
SCHEMBL2312159 0.77 ALDH1A1 (0.42) F2SMN1; SMN2POLBNLRP3HDAC6
SCHEMBL2311407 0.72 F2 (0.55) F10F2SMN1; SMN2PRSS1MEN1
SCHEMBL8903673 0.72 F2 (0.55) F10F2SMN1; SMN2PRSS1MEN1
SCHEMBL18065683 0.71 F2 (0.54) F10F2SMN1; SMN2PRSS1

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 11 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
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
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 F10 2429/4885F2 3847/4885LNPEP 346/4885

“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.