SCHEMBL6932157

SCHEMBL6932157

O=C(O)Cc1ccc(Sc2ccc(OCc3ccc4ccccc4n3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.67
AKR1B1 P15121 1/20 0.67
ALOX5 P09917 2/20 0.65
CYSLTR1 Q9Y271 11/20 0.64
CYSLTR2 Q9NS75 8/20 0.64
GPBAR1 Q8TDU6 1/20 0.62

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
SCHEMBL1419872 0.93 FFAR1 (0.77) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL6935065 0.86 GPBAR1 (0.85) FFAR1AKR1B1CYSLTR1CYSLTR2GPBAR1
SCHEMBL6934343 0.85 GPBAR1 (0.59) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL7807149 0.84 FFAR1 (0.68) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL9022221 0.84 CYSLTR1 (0.67) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL6089121 0.82 CYSLTR1 (0.69) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL13772730 0.82 GPBAR1 (0.70) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL8902567 0.82 ALOX5 (0.72) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL1419915 0.82 ALOX5 (0.72) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2
SCHEMBL9828714 0.81 FFAR1 (0.67) FFAR1AKR1B1ALOX5CYSLTR1CYSLTR2

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