SCHEMBL7653249

SCHEMBL7653249

CCOC(=O)CN[C@H]([C]=O)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPID Q08752 1/20 0.51
MMP8 P22894 1/20 0.48
GPR142 Q7Z601 1/20 0.44
LTA4H P09960 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CTSC P53634 1/20 0.41
PKM P14618 1/20 0.41
EPHX2 P34913 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL7653248 1.00 PPID (0.51) PPIDMMP8GPR142LTA4HSMN1; SMN2
SCHEMBL3168675 0.88 PPID (0.50) PPIDMMP8GPR142LTA4HSMN1; SMN2
SCHEMBL10933287 0.86 PPID (0.49) PPIDMMP8LTA4HSMN1; SMN2ALDH1A1
SCHEMBL10931162 0.86 PPID (0.49) PPIDMMP8LTA4HSMN1; SMN2ALDH1A1
SCHEMBL9554934 0.82 PPID (0.56) PPIDMMP8GPR142LTA4HSMN1; SMN2
SCHEMBL9185848 0.81 SIGMAR1 (0.56) PPIDMMP8LTA4HSMN1; SMN2
SCHEMBL7106567 0.81 MME (0.46) ALDH1A1CTSCPKM
SCHEMBL4847549 0.80 PPID (0.54) PPIDMMP8GPR142LTA4HSMN1; SMN2
SCHEMBL17287421 0.80 PPID (0.54) PPIDMMP8GPR142LTA4HALDH1A1
SCHEMBL7288750 0.80 MMP8 (0.50) MMP8SMN1; SMN2CTSC

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
US-6489291-B1 Topical composition for skin KAO CORPORATION (JP) 2002-12-03 US disclosed