SCHEMBL8991114

SCHEMBL8991114

CCNC(=O)c1ccccc1-c1ccc(CN2Cc3ccc(OC)cc3CC(NC(=O)CC(C)(C)N)C2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.41
GHSR Q92847 2/20 0.41
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
AGTR2 P50052 3/20 0.37
PPARG P37231 5/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
SCN9A Q15858 1/20 0.34
TACR1 P25103 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
SCHEMBL8991117 1.00 AGTR1 (0.41) AGTR1GHSRTAS1R3TAS1R1AGTR2
SCHEMBL8990818 0.90 GHSR (0.47) AGTR1GHSRTACR1
SCHEMBL8990812 0.90 GHSR (0.47) AGTR1GHSRTACR1
SCHEMBL8991023 0.90 GHSR (0.42) AGTR1GHSRTACR1
SCHEMBL8991029 0.90 GHSR (0.42) AGTR1GHSRTACR1
SCHEMBL8990799 0.88 GHSR (0.50) AGTR1GHSRMEN1KMT2ASCN9A
SCHEMBL8990824 0.85 GHSR (0.49) AGTR1GHSRMEN1KMT2ASCN9A
SCHEMBL8991074 0.84 AGTR1 (0.35) AGTR1TAS1R3TAS1R1AGTR2PPARG
SCHEMBL8990838 0.84 GHSR (0.51) AGTR1GHSRMEN1KMT2ASCN9A
SCHEMBL8991073 0.83 AGTR1 (0.46) AGTR1GHSRMEN1KMT2ASCN9A

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 4 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
WO-1995009633-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-04-13 WO claimed
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