SCHEMBL3934077

SCHEMBL3934077

CCC(CC)c1cc(C)nn2c(-c3sc(N(C)CCOC)nc3C)c(C)nc12

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.52
CRHR2 Q13324 1/20 0.49
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
SMPD3 Q9NY59 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
SCHEMBL3925940 0.92 CRHR1 (0.58) CRHR1CRHR2DPP4DPP8
SCHEMBL3923365 0.92 CRHR1 (0.49) CRHR1CRHR2
SCHEMBL3931698 0.90 CRHR1 (0.55) CRHR1CRHR2
SCHEMBL3934533 0.89 CRHR1 (0.51) CRHR1CRHR2SMPD3
SCHEMBL3925879 0.89 CRHR1 (0.56) CRHR1CRHR2
SCHEMBL3923296 0.89 CRHR1 (0.50) CRHR1CRHR2
SCHEMBL3932620 0.87 CRHR1 (0.48) CRHR1CRHR2DPP4DPP8
SCHEMBL3924181 0.87 CRHR1 (0.58) CRHR1CRHR2
SCHEMBL3925214 0.86 CRHR1 (0.52) CRHR1CRHR2
SCHEMBL3931301 0.86 CRHR1 (0.53) CRHR1CRHR2

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
EP-1869049-B1 IMIDAZOPYRIDAZINE COMPOUNDS LILLY CO ELI (US) 2009-03-04 EP disclosed