SCHEMBL11211030

SCHEMBL11211030

O=C(Nc1ccc(C(=O)Nc2ccc3cc(S(=O)(=O)O)cc(O)c3c2)cc1)Nc1ccc(C(=O)Nc2ccc3cc(S(=O)(=O)O)cc(O)c3c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 3/20 0.67
CASP6 P55212 2/20 0.67
NT5E P21589 2/20 0.67
CTDSP1 Q9GZU7 1/20 0.67
ENPP2 Q13822 4/20 0.61
TIMP3 P35625 3/20 0.57
NSD2 O96028 2/20 0.56
DUSP3 P51452 1/20 0.56
PTPN5 P54829 1/20 0.56
CASP7 P55210 1/20 0.56
PTPN11 Q06124 1/20 0.56
SIRT1 Q96EB6 1/20 0.51
FGF1 P05230 1/20 0.51
APEX1 P27695 1/20 0.48
CA2 P00918 2/20 0.47
CA1 P00915 1/20 0.47

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
SCHEMBL11489790 0.99 PRMT1 (0.66) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL10905567 0.93 CASP6 (0.67) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL11354668 0.91 TIMP3 (0.60) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL11342001 0.91 PRMT1 (0.82) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL26885948 0.91 NT5E (0.68) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL10900036 0.91 PRMT1 (0.81) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL29384348 0.91 PRMT1 (0.81) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL11582873 0.89 PRMT1 (0.63) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL7897823 0.89 CASP6 (0.65) PRMT1CASP6NT5ECTDSP1ENPP2
SCHEMBL6017879 0.89 CASP6 (0.84) PRMT1CASP6NT5ECTDSP1ENPP2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0013784-B1 C-SUBSTITUTED NAPHTHALENEMONOSULFONIC UREIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN CYANAMID COMPANY (US) 1983-02-23 EP claimed
US-4297372-A ANTIARTHRITIC AGENTS; COLLAGENASE AND PROTEOLYTIC ENZYME INHIBITORS; BONE, SKIN, AND ORAL DISORDERS AMERICAN CYANAMID COMPANY (US) 1981-10-27 US disclosed
EP-0013784-A1 C-Substituted naphthalenemonosulfonic ureides, process for their preparation and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1980-08-06 EP disclosed
US-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 US disclosed
US-4216166-A Nitro precursors to amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 US disclosed
US-4216164-A Ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 US disclosed