SCHEMBL8975361

SCHEMBL8975361

Cc1ccc(NC(=O)NC2CCCC(c3ccccc3)N(CC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 19/20 0.50
FPR2 P25090 1/20 0.42

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
SCHEMBL8922458 0.91 CCKBR (0.57) CCKBR
SCHEMBL8922128 0.77 CCKBR (0.61) CCKBR
SCHEMBL9541323 0.77 CCKBR (0.48) CCKBR
SCHEMBL9365638 0.75 CCKBR (0.63) CCKBR
SCHEMBL8920354 0.73 CCKBR (0.64) CCKBR
SCHEMBL9362777 0.72 CCKBR (0.49) CCKBR
SCHEMBL9362060 0.72 CCKBR (0.49) CCKBR
SCHEMBL8919164 0.71 CCKBR (0.48) CCKBR
SCHEMBL8922451 0.70 LMNA (0.38) CCKBR
SCHEMBL8921724 0.68 CCKBR (0.61) 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-5484917-A FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL DISORDERS, PAIN AND ANXIETY PFIZER INC. (US) 1996-01-16 US disclosed