SCHEMBL6937207

SCHEMBL6937207

O=C(O)Cc1ccccc1Sc1cccc(OCc2ccc3cc(Cl)ccc3n2)c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.47
GPBAR1 Q8TDU6 1/20 0.47
CYSLTR2 Q9NS75 7/20 0.47
ALOX5 P09917 1/20 0.42

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
SCHEMBL6932144 0.91 MMP2 (0.48) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL6932836 0.88 CYSLTR1 (0.51) CYSLTR1GPBAR1CYSLTR2
SCHEMBL6934343 0.79 GPBAR1 (0.59) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL6932236 0.76 CYSLTR1 (0.65) CYSLTR1GPBAR1CYSLTR2
SCHEMBL6090813 0.74 CYSLTR1 (0.69) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL9152799 0.72 CYP2C9 (0.57)
SCHEMBL6932132 0.72 GPBAR1 (0.60) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL6932107 0.71 MMP2 (0.70)
SCHEMBL5658878 0.70 CYP2C9 (0.66)
SCHEMBL4720632 0.70 HDAC1 (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086079-B1 DERIVATIVES OF HYDROXYPHENYLSULFANYLBENZOIC AND HYDROXYPHENYLSULFANYLARYLACETIC ACIDS LECIVA A S (CZ) 2003-05-07 EP disclosed
US-6303612-B1 USED AS ANTIINFLAMMATORY AND/OR ANTIASTHMATIC AGENTS LECIVA, A.S. (CZ) 2001-10-16 US disclosed
EP-1086079-A1 DERIVATIVES OF HYDROXYPHENYLSULFANYLBENZOIC AND HYDROXYPHENYLSULFANYLARYLACETIC ACIDS Leciva, A.S. (CZ) 2001-03-28 EP disclosed
WO-1999067208-A1 DERIVATIVES OF HYDROXYPHENYLSULFANYLBENZOIC AND HYDROXYPHENYLSULFANYLARYLACETIC ACIDS LECIVA, A.S. (CZ) 1999-12-29 WO disclosed