SCHEMBL7771309

SCHEMBL7771309

CNC(C)(Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)CCc1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.45
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.39
PTGFR P43088 1/20 0.39
CA2 P00918 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
GPR132 Q9UNW8 1/20 0.38
FCER2 P06734 1/20 0.38

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
SCHEMBL6657445 0.79 GHSR (0.52) GHSRMMP9MMP8KMT2AALDH1A1
SCHEMBL7771304 0.79 GHSR (0.52) GHSRMMP9MMP8KMT2AALDH1A1
SCHEMBL7771306 0.79 CA2 (0.45) KMT2AALDH1A1KDM4EPTGFRCA2
SCHEMBL8905440 0.79 FCER2 (0.58) MMP9MMP8FCER2
SCHEMBL5879498 0.78 ALDH1A1 (0.50) KMT2AALDH1A1KDM4EMEN1PTGFR
SCHEMBL5879436 0.78 ALDH1A1 (0.50) KMT2AALDH1A1KDM4EMEN1PTGFR
SCHEMBL6656758 0.78 ALDH1A1 (0.50) KMT2AALDH1A1KDM4EMEN1PTGFR
SCHEMBL19290059 0.75 ALDH1A1 (0.49) KMT2AALDH1A1KDM4EMEN1PTGFR
SCHEMBL16252293 0.75 ALDH1A1 (0.48) KMT2AALDH1A1KDM4EMEN1PTGFR
SCHEMBL18435475 0.75 ALDH1A1 (0.48) KMT2AALDH1A1KDM4EMEN1PTGFR

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-1127071-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES Novo Nordisk A/S (DK) 2001-08-29 EP disclosed
WO-2000026252-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-05-11 WO disclosed