SCHEMBL7791798

SCHEMBL7791798

CCNC(=O)NCc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)C(C)(C)N)CSc3cc(C(F)(F)F)ccc32)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.67
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
XBP1 P17861 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
XIAP P98170 1/20 0.38
F7 P08709 8/20 0.38
F3 P13726 8/20 0.38
F2 P00734 3/20 0.38
THRB P10828 1/20 0.36
FPR1 P21462 3/20 0.36
FPR2 P25090 3/20 0.36
AGTR1 P30556 1/20 0.35
F10 P00742 2/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 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
SCHEMBL7796084 0.94 GHSR (0.67) GHSRALDH1A1MAPTXBP1NPSR1
SCHEMBL8333260 0.94 GHSR (0.66) GHSRALDH1A1MAPTXBP1NPSR1
SCHEMBL7791998 0.92 GHSR (0.57) GHSRALDH1A1MAPTXBP1NPSR1
SCHEMBL7785981 0.92 GHSR (0.68) GHSRXIAPF7F3F2
SCHEMBL7791757 0.92 GHSR (0.56) GHSRALDH1A1MAPTXBP1NPSR1
SCHEMBL7791760 0.91 GHSR (0.55) GHSRALDH1A1MAPTXBP1NPSR1
SCHEMBL8330629 0.91 GHSR (0.75) GHSRXIAPF7F3F2
SCHEMBL7795592 0.90 GHSR (0.66) GHSRMAPTXIAPF7F3
SCHEMBL8332601 0.90 GHSR (0.66) GHSRXIAPF7F3F2
SCHEMBL7796023 0.88 GHSR (0.81) GHSRXIAPFPR1FPR2AGTR1

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
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 disclosed
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO disclosed