SCHEMBL8991024

SCHEMBL8991024

CCNC(=O)NCc1ccccc1-c1ccc(CN2Cc3ccc(F)cc3C[C@@H](NC(=O)CC(C)(C)N)C2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.51
AGTR1 P30556 1/20 0.40
OPRM1 P35372 3/20 0.37
OPRK1 P41145 2/20 0.37
OPRL1 P41146 2/20 0.37
TACR1 P25103 1/20 0.37
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36
DRD3 P35462 2/20 0.36
FNTA P49354 3/20 0.35
FNTB P49356 3/20 0.35
KCNA5 P22460 2/20 0.34
KCNH2 Q12809 1/20 0.33
HTR7 P34969 1/20 0.33
MCHR1 Q99705 1/20 0.33
OPRD1 P41143 1/20 0.33

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
SCHEMBL8990829 0.94 GHSR (0.52) GHSRAGTR1OPRM1OPRK1OPRL1
SCHEMBL8991044 0.92 GHSR (0.60) GHSROPRM1OPRK1OPRL1TACR1
SCHEMBL8990994 0.92 GHSR (0.42) GHSRAGTR1OPRM1OPRK1OPRL1
SCHEMBL8991111 0.92 GHSR (0.57) GHSRAGTR1OPRM1TACR1FNTA
SCHEMBL8990799 0.90 GHSR (0.50) GHSRAGTR1TACR1DRD2DRD4
SCHEMBL8991008 0.89 GHSR (0.44) GHSRAGTR1OPRM1OPRK1OPRL1
SCHEMBL8991037 0.88 GHSR (0.44) GHSRAGTR1OPRM1OPRK1OPRL1
SCHEMBL8991029 0.88 GHSR (0.42) GHSRAGTR1OPRM1OPRK1OPRL1
SCHEMBL8991023 0.88 GHSR (0.42) GHSRAGTR1OPRM1OPRK1OPRL1
SCHEMBL8990958 0.86 GHSR (0.61) GHSROPRM1OPRK1OPRL1TACR1

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
US-5545735-A ANIMAL GROWTH REGULATORS MERCK & CO., INC. (US) 1996-08-13 US claimed
US-5545735-A ANIMAL GROWTH REGULATORS MERCK & CO., INC. (US) 1996-08-13 US disclosed