SCHEMBL6440181

SCHEMBL6440181

CC(OC(=O)N1Cc2n[nH]c(N)c2C1)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 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
SCHEMBL3480008 0.85 NR1H2 (0.40) NR1H2
SCHEMBL22492311 0.74 ADORA1 (0.47) NR1H2
SCHEMBL22492346 0.74 ADORA1 (0.50) NR1H2
SCHEMBL24209724 0.72 ADORA1 (0.43) NR1H2
SCHEMBL2923652 0.71 CCNA2 (0.38)
SCHEMBL5720840 0.71 NR1H2 (0.40) NR1H2
SCHEMBL30090465 0.71 NR1H2 (0.40) NR1H2
SCHEMBL30707227 0.69 NR1H2 (0.39) NR1H2
SCHEMBL29723403 0.68 NR1H2 (0.38) NR1H2
SCHEMBL24209760 0.68 ADORA1 (0.45) NR1H2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1527074-A1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2005-05-04 EP disclosed
WO-2004013144-A1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2004-02-12 WO disclosed