SCHEMBL6865201

SCHEMBL6865201

Nc1ccc(S(=O)(=O)c2cccc(C(=O)O)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 2/20 0.55
F2 P00734 3/20 0.54
PRSS1 P07477 3/20 0.54
PRSS2 P07478 3/20 0.54
PRSS3 P35030 3/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
LMNA P02545 3/20 0.53
HTR6 P50406 2/20 0.53
MPO P05164 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
TSHR P16473 1/20 0.53
MAPT P10636 1/20 0.53
IL1RN P18510 1/20 0.53
ALDH1A1 P00352 2/20 0.51
PKM P14618 1/20 0.51
ANXA2 P07355 1/20 0.49
S100A10 P60903 1/20 0.49
CYP2C19 P33261 1/20 0.48

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
SCHEMBL5581691 0.91 MAPT (0.60) F2PRSS1PRSS2PRSS3CA1
SCHEMBL2746739 0.88 MAPT (0.57) F2PRSS1PRSS2PRSS3CA1
SCHEMBL30307439 0.88 MAPT (0.57) F2PRSS1PRSS2PRSS3CA1
SCHEMBL1000532 0.88 MAPT (0.60) F2PRSS1PRSS2PRSS3CA1
SCHEMBL2405304 0.88 F2 (0.61) F2PRSS1PRSS2PRSS3CA1
SCHEMBL29964265 0.88 F2 (0.61) F2PRSS1PRSS2PRSS3CA1
SCHEMBL999837 0.83 CXCR2 (0.57) F2PRSS1PRSS2PRSS3CA1
SCHEMBL6863962 0.83 LMNA (0.67) F2PRSS1PRSS2PRSS3CA1
SCHEMBL900931 0.82 TSHR (0.67) PRMT1F2PRSS1PRSS2PRSS3
SCHEMBL324582 0.82 HTR6 (0.73) CA1CA2LMNAHTR6MPO

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-6808766-B1 ALIGNMENT AGENT COMPRISING POLYURETHANE OR POLYUREA, USED IN ALIGNMENT OF LIQUID CRYSTAL MOLECULES THAT FORM LIQUID CRYSTAL ALIGNMENT FILM BY IRRADIATING THIN ALIGNMENT FILM FORMED ON SUBSTRATE WITH POLARIZED LIGHT OR ELECTRON RAYS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-10-26 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed