SCHEMBL6602302

SCHEMBL6602302

CN(C(=O)C(Cc1ccc2ccccc2c1)NC(=O)/C=C/CC(C)(C)N)C(Cc1ccccc1)c1nc(C(=O)NCc2ccccc2)no1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.42
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
FCER2 P06734 1/20 0.36
TACR1 P25103 3/20 0.35
MMP2 P08253 1/20 0.35
BMP1 P13497 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
SCHEMBL6601286 0.93 GHSR (0.44) GHSRMMP9MMP8FCER2TACR1
SCHEMBL6599917 0.91 GHSR (0.43) GHSRMMP9MMP8TACR1
SCHEMBL6602261 0.89 GHSR (0.41) GHSRMMP9MMP8FCER2TACR1
SCHEMBL6600613 0.86 GHSR (0.46) GHSRMMP9MMP8TACR1
SCHEMBL13808414 0.85 MMP9 (0.40) GHSRMMP9MMP8FCER2TACR1
SCHEMBL13808413 0.85 MMP9 (0.40) GHSRMMP9MMP8FCER2TACR1
SCHEMBL3726874 0.85 MMP9 (0.40) GHSRMMP9MMP8FCER2TACR1
SCHEMBL6600377 0.85 CTSS (0.50) MMP9MMP8FCER2
SCHEMBL6601083 0.82 MC4R (0.41) GHSRFCER2BMP1
SCHEMBL6600530 0.78 MMP9 (0.44) GHSRMMP9MMP8TACR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805816-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-07-28 EP claimed