SCHEMBL8990746

SCHEMBL8990746

CCNC(=O)c1ccccc1-c1ccc(CN2Cc3ccccc3CC(NC(=O)C(C)(C)N)C2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.50
HDAC1 Q13547 2/20 0.41
HDAC7 Q8WUI4 1/20 0.41
TACR1 P25103 2/20 0.40
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
DRD3 P35462 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
AGTR1 P30556 1/20 0.37
PRMT5 O14744 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 1/20 0.36

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
SCHEMBL8990748 1.00 GHSR (0.50) GHSRHDAC1HDAC7TACR1MME
SCHEMBL8990812 0.91 GHSR (0.47) GHSRHDAC1HDAC7TACR1MME
SCHEMBL8990818 0.91 GHSR (0.47) GHSRHDAC1HDAC7TACR1MME
SCHEMBL8990737 0.90 GHSR (0.43) GHSRHDAC1HDAC7TACR1KMT2A
SCHEMBL8990744 0.90 GHSR (0.43) GHSRHDAC1HDAC7TACR1KMT2A
SCHEMBL8991128 0.86 GHSR (0.68) GHSRTACR1MMEACEHRH4
SCHEMBL8990879 0.85 GHSR (0.52) GHSRHDAC1HDAC7TACR1MME
SCHEMBL8990974 0.85 GHSR (0.45) GHSRHDAC1HDAC7DRD3MEN1
SCHEMBL8990967 0.85 GHSR (0.45) GHSRHDAC1HDAC7DRD3MEN1
SCHEMBL8991023 0.83 GHSR (0.42) GHSRHDAC1HDAC7TACR1AGTR1

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 3 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