SCHEMBL8050858

SCHEMBL8050858

CCCCCCC(C)OC(=O)CCc1cc(-n2nc3ccc(S(=O)(=O)c4ccccc4)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.34
ALDH1A1 P00352 1/20 0.33
PTGS2 P35354 2/20 0.33
MAOB P27338 3/20 0.32
MAOA P21397 2/20 0.32
MAPT P10636 1/20 0.31
GAA P10253 2/20 0.30
ACHE P22303 1/20 0.30
KMT2A Q03164 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL769424 0.89 ALDH1A1 (0.37) ALDH1A1MAOBMAOAMAPTGAA
SCHEMBL5834156 0.88 CNR2 (0.37) ALDH1A1PTGS2MAOBMAOACNR2
SCHEMBL6290686 0.86 ALOX5 (0.33) MAOBMAOAGAAACHEKMT2A
SCHEMBL1262791 0.86 MAPT (0.42) ALDH1A1MAOBMAOAMAPTGAA
SCHEMBL4822523 0.84 MAOB (0.40) ALDH1A1MAOBMAOAGAAACHE
SCHEMBL5627436 0.83 MAOB (0.38) ALDH1A1MAOBMAOAGAAACHE
SCHEMBL8054369 0.82 MAOB (0.31) MAOBMAOAACHE
SCHEMBL7787071 0.81 MAOB (0.37) ALDH1A1MAOBMAOAGAAACHE
SCHEMBL5834851 0.81 MAOB (0.37) ALDH1A1MAOBMAOAGAAACHE
SCHEMBL4445488 0.81 GAA (0.35) ALDH1A1MAOBMAOAMAPTGAA

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-0572554-B1 5-SULFONYL-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA SC HOLDING AG (CH) 2000-05-10 EP claimed
US-5280124-A Having a phenol structure in position 2 CIBA-GEIGY CORPORATION (US) 1994-01-18 US claimed
EP-0572554-A1 5-SULFONYL-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS Ciba SC Holding AG (CH) 1993-12-08 EP claimed
WO-1992014717-A1 5-SULFONYL-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA-GEIGY AG (CH) 1992-09-03 WO claimed