SCHEMBL7473078

SCHEMBL7473078

O=S(=O)(Nc1ccccc1OCc1ccccc1)c1ccc(N2CCC(c3ccccc3)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.47
GHSR Q92847 1/20 0.46
MMP3 P08254 1/20 0.46
PTGES2 Q9H7Z7 2/20 0.44
ACLY P53396 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
SLC40A1 Q9NP59 1/20 0.42
MALT1 Q9UDY8 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 2/20 0.41
TP53 P04637 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
SCHEMBL8752447 0.75 CYP19A1 (0.69) CYP19A1PTGES2ACLYSLC40A1HDAC3
SCHEMBL6416265 0.74 MMP3 (0.60) MMP3MMP2MMP9MMP13ALDH1A1
SCHEMBL6416258 0.74 MMP3 (0.60) MMP3MMP2MMP9MMP13ALDH1A1
SCHEMBL7468288 0.74 MMP3 (0.47) MMP3MMP2MMP9MMP13SMN1; SMN2
SCHEMBL19381716 0.72 HTR1A (0.47) KDM4ETP53ALDH1A1GAAHTR6
SCHEMBL4431378 0.72 MMP3 (0.70) MMP3MMP2MMP9MMP13ALDH1A1
SCHEMBL4431389 0.72 MMP3 (0.70) MMP3MMP2MMP9MMP13ALDH1A1
SCHEMBL6418278 0.72 MMP3 (0.70) MMP3MMP2MMP9MMP13ALDH1A1
SCHEMBL4426623 0.71 MMP3 (0.54) MMP3MMP2MMP9MMP13SMN1; SMN2
SCHEMBL3107582 0.71 MMP2 (0.46) MMP3MMP2MMP9MMP13SMN1; SMN2

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-0874836-B1 SULFONAMIDE INHIBITORS OF MATRIX METALLOPROTEINASES WARNER LAMBERT CO (US) 2002-10-09 EP disclosed