SCHEMBL9752983

SCHEMBL9752983

CCc1ccc2c(C(C)C)c(CO)c(-c3ccc(F)cc3)nn12

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.43
TGFBR1 P36897 2/20 0.35
TGFBR2 P37173 1/20 0.35

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
SCHEMBL9753426 0.86 GCGR (0.40) GCGRTGFBR1TGFBR2
SCHEMBL9753771 0.85 GCGR (0.40) GCGRTGFBR1TGFBR2
SCHEMBL9753309 0.85 MAPK14 (0.43) GCGRTGFBR1TGFBR2
SCHEMBL9753336 0.84 MAPK14 (0.42) GCGRTGFBR1TGFBR2
SCHEMBL9752952 0.84 GCGR (0.39) GCGRTGFBR1TGFBR2
SCHEMBL9753406 0.82 GCGR (0.38) GCGRTGFBR1TGFBR2
SCHEMBL9753720 0.82 GCGR (0.38) GCGRTGFBR1TGFBR2
SCHEMBL9753125 0.81 GCGR (0.37) GCGR
SCHEMBL9753363 0.81 DHODH (0.38) GCGR
SCHEMBL9752958 0.81 PTGDR2 (0.39) GCGR

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
WO-1991018903-A1 PYRROLOPYRIDAZINE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-12 WO disclosed
CN-1056690-A PYRROLOPYRIDAZINE COMPOUNDS FUJISAWA PHARMACEUTICAL CO (JP) 1991-12-04 CN disclosed