SCHEMBL6554325

SCHEMBL6554325

C=Cc1ccc(Cl)c(S(=O)(=O)O)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL6554374 0.82 TDP1 (0.35) TDP1ALDH1A1CYP2C9
SCHEMBL11837076 0.79 TDP1 (0.41) TDP1ALDH1A1CYP2C9
SCHEMBL8356169 0.78 ALDH1A1 (0.50) TDP1ALDH1A1CYP2C9
SCHEMBL18289495 0.78 TDP1 (0.46) TDP1ALDH1A1
SCHEMBL8338086 0.76 TDP1 (0.38) TDP1ALDH1A1
SCHEMBL8977584 0.72 CYP3A4 (0.50) TDP1ALDH1A1CYP2C9
SCHEMBL11789072 0.72 CYP2C9 (0.39) ALDH1A1CYP2C9
SCHEMBL11832328 0.71 ALDH1A1 (0.35) TDP1ALDH1A1
SCHEMBL59762 0.71 ALDH1A1 (0.48) TDP1ALDH1A1
SCHEMBL2871378 0.70 TDP1 (0.50) TDP1ALDH1A1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0841415-B1 Fine inorganic particles containing fibres and method for forming the same JAPAN EXLAN CO LTD (JP) 2004-02-25 EP disclosed
US-5928785-A ACRYLIC POLYMER WITH POLAR GROUPS SELECTED FROM SULFONIC ACID GROUP, CARBOXYL CROUP AND PHOSPHORIC ACID GROUP JAPAN EXLAN COMPANY LIMITED (JP) 1999-07-27 US disclosed
EP-0841415-A2 Fine inorganic particles containing fibres and method for forming the same JAPAN EXLAN COMPANY LIMITED (JP) 1998-05-13 EP disclosed