SCHEMBL7763247

SCHEMBL7763247

CC(=NO)C(CCCc1ccc(-c2ccccc2)cc1)CC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.52
MMP12 P39900 4/20 0.52
MMP13 P45452 2/20 0.52
MMP9 P14780 1/20 0.52
MMP14 P50281 1/20 0.52
MMP3 P08254 4/20 0.46
FFAR1 O14842 1/20 0.45
FDFT1 P37268 1/20 0.45

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
SCHEMBL7763242 1.00 MMP2 (0.52) MMP2MMP12MMP13MMP9MMP14
SCHEMBL6271177 0.88 MMP2 (0.58) MMP2MMP9MMP14MMP3
SCHEMBL6271174 0.88 MMP2 (0.58) MMP2MMP9MMP14MMP3
SCHEMBL7758600 0.86 MMP12 (0.60) MMP2MMP12MMP13MMP9MMP14
SCHEMBL7758550 0.76 MMP2 (0.51) MMP2MMP3
SCHEMBL7758555 0.76 MMP2 (0.51) MMP2MMP3
SCHEMBL7765346 0.74 MMP2 (0.47) MMP2MMP12MMP13MMP9MMP14
SCHEMBL16980966 0.74 MMP12 (0.69) MMP2MMP12MMP13MMP9MMP14
SCHEMBL7319632 0.74 GRIK1 (0.64) MMP2MMP3
SCHEMBL7762255 0.73 MMP2 (0.49) MMP2MMP12MMP13MMP9MMP14

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-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP claimed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO claimed