SCHEMBL8975223

SCHEMBL8975223

COc1cccc(C2CC(c3ccccc3)N(CC(=O)NC(C)(C)C)C(=O)C(N(C(N)=O)c3cccc(C)c3)C2)c1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.55

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
SCHEMBL8921102 0.93 CCKBR (0.51) CCKBR
SCHEMBL8921495 0.92 CCKBR (0.62) CCKBR
SCHEMBL8975689 0.85 CCKBR (0.52) CCKBR
SCHEMBL8920293 0.84 CCKBR (0.53) CCKBR
SCHEMBL8921774 0.83 CCKBR (0.53) CCKBR
SCHEMBL8919257 0.83 CCKBR (0.53) CCKBR
SCHEMBL8922602 0.83 CCKBR (0.40) CCKBR
SCHEMBL8922608 0.83 CCKBR (0.40) CCKBR
SCHEMBL8925458 0.83 CCKBR (0.52) CCKBR
SCHEMBL8920519 0.83 CCKBR (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532270-A Composition and process for prevention and treatment of cutaneous immediate hypersensitivity reactions ASCENT PHARMACEUTICALS, INC. (US) 1996-07-02 US disclosed
US-5484917-A FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL DISORDERS, PAIN AND ANXIETY PFIZER INC. (US) 1996-01-16 US disclosed