SCHEMBL7373348

SCHEMBL7373348

NC(=O)N1CC[C](C(Cl)c2ccc3ccncc3c2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 17/20 0.38
ROCK2 O75116 2/20 0.35
GSK3B P49841 1/20 0.33

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
SCHEMBL7374639 0.88 CYP11B2 (0.38) CYP11B2ROCK2GSK3B
SCHEMBL7374808 0.82 CYP11B2 (0.43) CYP11B2
Hydrochloric Acid SCHEMBL7384122 0.66 IDO1 (0.33) CYP11B2ROCK2GSK3B
SCHEMBL27524276 0.66 PRKCZ (0.43) ROCK2
SCHEMBL7378233 0.64 AKT1 (0.36) ROCK2GSK3B
SCHEMBL7371755 0.64 GSK3B (0.38) ROCK2GSK3B
SCHEMBL7368498 0.64 TPH1 (0.33) CYP11B2ROCK2
SCHEMBL7371015 0.64 TPH1 (0.33) CYP11B2ROCK2
Hydrochloric Acid SCHEMBL28743883 0.64 PRKCZ (0.44) ROCK2
Hydrochloric Acid SCHEMBL7374530 0.64 GSK3B (0.34) ROCK2GSK3B

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
EP-1086099-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2002-01-02 EP disclosed
EP-0944386-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2001-04-11 EP disclosed
EP-1086099-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-03-28 EP disclosed
WO-1999062904-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-12-09 WO disclosed
EP-0944386-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-09-29 EP disclosed
WO-1998025611-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-06-18 WO disclosed