SCHEMBL5760263

SCHEMBL5760263

CC1C(=O)N[C@H](Cc2ccccc2)C(=O)N1Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.54
MMP3 P08254 2/20 0.54
MMP9 P14780 2/20 0.54
GAA P10253 2/20 0.54
POLB P06746 1/20 0.54
PLA2G10 O15496 1/20 0.52
PLA2G5 P39877 1/20 0.52
CYP3A4 P08684 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2C9 P11712 1/20 0.49
CYP1A2 P05177 1/20 0.47
EP300 Q09472 1/20 0.45
EHMT2 Q96KQ7 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
SMO Q99835 2/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
GHSR Q92847 1/20 0.43

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
SCHEMBL3556442 1.00 MMP1 (0.54) MMP1MMP3MMP9GAAPOLB
SCHEMBL3557914 1.00 MMP1 (0.54) MMP1MMP3MMP9GAAPOLB
SCHEMBL14607231 0.88 MMP1 (0.48) MMP1MMP3MMP9GAAPOLB
SCHEMBL10117595 0.88 MMP1 (0.48) MMP1MMP3MMP9GAAPOLB
SCHEMBL10134835 0.88 MMP1 (0.48) MMP1MMP3MMP9GAAPOLB
SCHEMBL23040234 0.88 MMP1 (0.48) MMP1MMP3MMP9GAAPOLB
SCHEMBL11959439 0.88 MMP1 (0.48) MMP1MMP3MMP9GAAPOLB
SCHEMBL23040054 0.88 MMP1 (0.48) MMP1MMP3MMP9GAAPOLB
SCHEMBL23646101 0.87 MMP1 (0.47) MMP1MMP3MMP9GAAPOLB
SCHEMBL23040273 0.86 MMP1 (0.46) MMP1MMP3MMP9GAAEHMT2

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-1675859-A1 MODULATORS OF SEROTONIN RECEPTORS Bristol-Myers Squibb Company (US) 2006-07-05 EP disclosed
WO-2005035533-A1 MODULATORS OF SEROTONIN RECEPTORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-04-21 WO disclosed