SCHEMBL7785982

SCHEMBL7785982

CSc1ccc2c(c1)SC[C@@H](NC(=O)C(C)(C)N)C(=O)N2Cc1ccc(-c2ccccc2CNC(N)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.55
XIAP P98170 2/20 0.39
F7 P08709 11/20 0.37
F3 P13726 11/20 0.37
F2 P00734 4/20 0.37
AGTR1 P30556 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
F10 P00742 2/20 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
SCHEMBL7794697 0.93 GHSR (0.65) GHSRXIAPF7F3F2
SCHEMBL8326452 0.92 GHSR (0.47) GHSRXIAPF7F3F2
SCHEMBL8332601 0.92 GHSR (0.66) GHSRXIAPF7F3F2
SCHEMBL8329860 0.92 GHSR (0.66) GHSRXIAPF7F3F2
SCHEMBL7791823 0.91 GHSR (0.46) GHSRXIAPF7F3F2
SCHEMBL7791816 0.90 GHSR (0.45) GHSRXIAPF7F3F2
SCHEMBL7786058 0.90 GHSR (0.57) GHSRXIAPF7F3F2
SCHEMBL7795973 0.89 GHSR (0.63) GHSRXIAPF7F3F2
SCHEMBL7791757 0.89 GHSR (0.56) GHSRXIAPF7F3F2
SCHEMBL7794398 0.88 GHSR (0.55) GHSRXIAPF7F3F2

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
EP-0659179-B1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 2001-11-21 EP claimed
US-5968924-A HAVE THE ABILITY TO STIMULATE THE RELEASE OF NATURAL OR ENDOGENOUS GROWTH HORMONE; TREATMENT OF OBESITY, OSTEOPOROSIS MERCK & CO., INC. (US) 1999-10-19 US claimed
US-5968924-A HAVE THE ABILITY TO STIMULATE THE RELEASE OF NATURAL OR ENDOGENOUS GROWTH HORMONE; TREATMENT OF OBESITY, OSTEOPOROSIS MERCK & CO., INC. (US) 1999-10-19 US disclosed
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO disclosed