SCHEMBL8904289

SCHEMBL8904289

Cc1cccc(NC(=O)NC2CSc3ccccc3N(C)C2=O)c1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.59
KCNH2 Q12809 1/20 0.52

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
SCHEMBL8904285 1.00 CCKBR (0.59) CCKBRKCNH2
SCHEMBL9435303 0.81 CCKBR (0.68) CCKBR
SCHEMBL8904366 0.81 CCKBR (0.68) CCKBR
SCHEMBL8903002 0.81 CCKBR (0.72) CCKBR
SCHEMBL8903211 0.81 CCKBR (0.72) CCKBR
SCHEMBL3148741 0.81 RIPK1 (0.60)
SCHEMBL3148748 0.81 RIPK1 (0.60)
SCHEMBL8905038 0.80 CCKBR (0.57) CCKBR
SCHEMBL8905032 0.80 CCKBR (0.57) CCKBR
SCHEMBL8903122 0.80 CCKBR (0.53) CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618808-A Benzothiazepine and benzoxazepine derivatives as cholecystokinin receptor antagonists PFIZER, INC. (US) 1997-04-08 US disclosed