SCHEMBL15875950

SCHEMBL15875950

COc1nc(C)c(N2c3nc4cccc(C(OC(F)F)C(F)(F)F)c4n3CCC2Cl)c(C)n1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.54

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
SCHEMBL15875897 0.84 CRHR1 (0.55) CRHR1
SCHEMBL3759166 0.83 CRHR1 (0.73) CRHR1
SCHEMBL3746202 0.70 CRHR1 (1.00) CRHR1
SCHEMBL3666933 0.70 CRHR1 (0.56) CRHR1
SCHEMBL3754071 0.69 CRHR1 (0.82) CRHR1
SCHEMBL3668220 0.68 CRHR1 (0.81) CRHR1
SCHEMBL3751403 0.67 CRHR1 (0.77) CRHR1
SCHEMBL3760990 0.63 CRHR1 (0.87) CRHR1
SCHEMBL3756720 0.62 CRHR1 (0.84) CRHR1
SCHEMBL3756348 0.62 CRHR1 (0.84) CRHR1

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-8785460-B2 Tricyclic compounds and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-22 US claimed