SCHEMBL7743228

SCHEMBL7743228

CC1(C)CC(OC(=O)N2CCN(Cc3cnc[nH]3)C(Cc3ccc(C#N)cc3)C2)CC(C)(C)C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.43
FNTB P49356 15/20 0.43
HRH3 Q9Y5N1 1/20 0.37
RAB9A P51151 1/20 0.36
PGGT1B P53609 2/20 0.35
HRAS P01112 1/20 0.35
KRAS P01116 1/20 0.35
GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL7748858 0.91 FNTA (0.41) FNTAFNTBHRH3PGGT1BHRAS
SCHEMBL7750454 0.85 FNTA (0.42) FNTAFNTBHRH3PGGT1BHRAS
SCHEMBL7743244 0.84 GPR119 (0.49) FNTAFNTBHRH3GPR119
SCHEMBL7747657 0.83 FNTA (0.42) FNTAFNTBHRH3PGGT1BHRAS
SCHEMBL7743208 0.82 FNTA (0.47) FNTAFNTBHRH3PGGT1BHRAS
SCHEMBL7162634 0.81 FNTA (0.52) FNTAFNTBPGGT1BHRASKRAS
SCHEMBL7747674 0.80 FNTA (0.45) FNTAFNTBHRH3PGGT1BHRAS
SCHEMBL7747665 0.77 FNTA (0.43) FNTAFNTBHRH3PGGT1BHRAS
SCHEMBL7747199 0.76 MPG (0.40) FNTAFNTBHRH3
SCHEMBL7119884 0.75 HRH3 (0.37) FNTAFNTBHRH3RAB9APGGT1B

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
WO-2001022963-A1 METHOD OF PREVENTING OSTEOPOROSIS MERCK & CO., INC. (US) 2001-04-05 WO claimed