SCHEMBL11347346

SCHEMBL11347346

O=C(Nc1ccc(C(=O)Nc2ccc(O)c3ccc(S(=O)(=O)O)cc23)cc1)Nc1ccc(C(=O)Nc2ccc(O)c3ccc(S(=O)(=O)O)cc23)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 5/20 0.60
FGF1 P05230 1/20 0.54
PRMT1 Q99873 2/20 0.53
F11 P03951 2/20 0.52
CASP6 P55212 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.51
HPSE Q9Y251 1/20 0.49
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
RECQL P46063 2/20 0.47
HSD17B10 Q99714 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
APEX1 P27695 2/20 0.45
SIRT1 Q96EB6 1/20 0.45
ELANE P08246 1/20 0.45
CTSG P08311 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
SCHEMBL11344456 0.96 TIMP3 (0.58) TIMP3FGF1PRMT1F11CASP6
SCHEMBL10908164 0.93 TIMP3 (0.51) TIMP3FGF1PRMT1F11CASP6
SCHEMBL10905317 0.89 TIMP3 (0.50) TIMP3FGF1PRMT1F11CASP6
SCHEMBL11342408 0.88 TIMP3 (0.62) TIMP3FGF1PRMT1HPSEKMT2A
SCHEMBL11436818 0.88 CASP6 (0.63) TIMP3PRMT1CASP6CTDSP1CA1
SCHEMBL11339145 0.86 TIMP3 (0.58) TIMP3FGF1PRMT1F11CASP6
SCHEMBL11344033 0.86 HPSE (0.48) TIMP3FGF1PRMT1CASP6CTDSP1
SCHEMBL11437659 0.84 MAPT (0.62) CASP6CTDSP1CA1CA2KMT2A
SCHEMBL11351829 0.84 TIMP3 (0.58) TIMP3FGF1PRMT1F11CASP6
SCHEMBL11343939 0.83 RECQL (0.62) TIMP3PRMT1HPSEKMT2AMEN1

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
US-4297372-A ANTIARTHRITIC AGENTS; COLLAGENASE AND PROTEOLYTIC ENZYME INHIBITORS; BONE, SKIN, AND ORAL DISORDERS AMERICAN CYANAMID COMPANY (US) 1981-10-27 US disclosed
US-4216164-A Ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 US disclosed