SCHEMBL7794624

SCHEMBL7794624

CCCC(=O)N[C@@H]1CSc2cc(OC)ccc2N(Cc2ccc(-c3ccccc3CNC(N)=O)cc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.45
F7 P08709 5/20 0.38
F3 P13726 5/20 0.38
XIAP P98170 2/20 0.38
HTR7 P34969 3/20 0.37
F2 P00734 1/20 0.36
PLA2G2A P14555 2/20 0.35
AGTR1 P30556 1/20 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
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 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
SCHEMBL7792009 0.94 GHSR (0.46) GHSRF7F3XIAPHTR7
SCHEMBL7785745 0.92 GHSR (0.52) GHSRF7F3XIAPHTR7
SCHEMBL7791835 0.92 GHSR (0.53) GHSRF7F3XIAPHTR7
SCHEMBL7786087 0.91 GHSR (0.53) GHSRF7F3XIAPHTR7
SCHEMBL7791796 0.91 GHSR (0.47) GHSRF7F3XIAPHTR7
SCHEMBL7794398 0.90 GHSR (0.55) GHSRF7F3XIAPHTR7
SCHEMBL7791888 0.90 GHSR (0.46) GHSRF7F3XIAPHTR7
SCHEMBL7796037 0.90 GHSR (0.51) GHSRF7F3XIAPF2
SCHEMBL7791816 0.89 GHSR (0.45) GHSRF7F3XIAPF2
SCHEMBL7795578 0.89 GHSR (0.47) GHSRF7F3XIAPF2

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
EP-0659179-B1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 2001-11-21 EP claimed
EP-0659179-B1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 2001-11-21 EP disclosed