SCHEMBL7487974

SCHEMBL7487974

Cc1oc(-c2ccccc2S(C)(=O)=O)c(Oc2ccc(F)cc2)c(=O)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.42
PTGS1 P23219 4/20 0.37
MAPT P10636 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 2/20 0.35
RAB9A P51151 1/20 0.35
HSD11B1 P28845 1/20 0.34
HPGD P15428 1/20 0.34
GAPDH P04406 1/20 0.34
NPBWR1 P48145 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL7474599 0.91 ALDH1A1 (0.44) PTGS2PTGS1MAPTCES2CES1
SCHEMBL5094209 0.80 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL1376503 0.73 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL5101395 0.70 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL1376798 0.67 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL1379215 0.67 PTGS2 (0.54) PTGS2PTGS1HSD11B1
SCHEMBL1377386 0.67 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7482337 0.67 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL7606499 0.65 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL7556388 0.64 PTGS2 (0.64) PTGS2PTGS1ALDH1A1KDM4ERAB9A

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
EP-1263751-A1 2-PHENYLPYRAN-4-ONE DERIVATIVES Almirall Prodesfarma AG (CH) 2002-12-11 EP claimed
WO-2001068633-A1 2-PHENYLPYRAN-4-ONE DERIVATIVES ALMIRALL PRODESFARMA AG (CH) 2001-09-20 WO claimed