SCHEMBL8991113

SCHEMBL8991113

CC(C)(C)OC(=O)NCc1ccccc1-c1ccc(CN2Cc3ccccc3CC(NC(=O)OCc3ccccc3)C2=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.42
NAMPT P43490 1/20 0.42
HRH4 Q9H3N8 1/20 0.41
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
NAAA Q02083 1/20 0.39
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
TACR1 P25103 1/20 0.38
KCNA5 P22460 1/20 0.38
SYK P43405 1/20 0.38
SCN9A Q15858 1/20 0.38
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37

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
SCHEMBL8991119 1.00 GHSR (0.42) GHSRNAMPTHRH4MMEACE
SCHEMBL8991005 0.83 GHSR (0.55) GHSRNAMPTHRH4MMEACE
SCHEMBL8990790 0.81 GHSR (0.54) GHSRNAMPTHRH4MMEACE
SCHEMBL8991136 0.81 GHSR (0.46) GHSRNAMPTHRH4MMEACE
SCHEMBL8990794 0.80 HRH4 (0.43) HRH4MMEACEOPRM1OPRD1
SCHEMBL8990800 0.80 HRH4 (0.43) HRH4MMEACEOPRM1OPRD1
SCHEMBL7794388 0.80 GHSR (0.64) GHSRACEPTGER1PTGER4PTGER3
SCHEMBL7794392 0.80 GHSR (0.64) GHSRACEPTGER1PTGER4PTGER3
SCHEMBL8991054 0.79 GHSR (0.56) GHSRHRH4MMEACEOPRM1
SCHEMBL8990816 0.78 GHSR (0.68) GHSRHRH4MMEACEOPRM1

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 disclosed
WO-1995009633-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-04-13 WO disclosed