SCHEMBL9658484

SCHEMBL9658484

CCCCCCc1c(OC)c(O)c2cc(C)ccc2c1O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.55
PTGS2 P35354 4/20 0.40
LDHA P00338 1/20 0.40
LDHB P07195 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL9657719 0.90 LDHA (0.49) ALOX5LDHALDHBKDM4EALDH1A1
SCHEMBL9656389 0.85 ALOX5 (0.56) ALOX5PTGS2KDM4EALDH1A1HPGD
SCHEMBL9657975 0.84 ALOX5 (0.54) ALOX5PTGS2KDM4EALDH1A1HPGD
SCHEMBL9654924 0.74 ABCB11 (0.42) ALOX5LDHALDHBKDM4EALDH1A1
SCHEMBL9657723 0.74 ALOX5 (0.38) ALOX5PTGS2LDHALDHBKDM4E
SCHEMBL9657954 0.74 ABCB11 (0.42) ALOX5LDHALDHBKDM4EALDH1A1
SCHEMBL9629355 0.74 LDHA (0.48) ALOX5LDHALDHBKDM4EALDH1A1
SCHEMBL9657958 0.74 LDHA (0.48) ALOX5LDHALDHBKDM4EALDH1A1
SCHEMBL9656656 0.74 LDHA (0.41) LDHALDHBKDM4EALDH1A1HPGD
SCHEMBL9627724 0.73 ALOX5 (0.48) ALOX5PTGS2LDHALDHBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5134161-A Enzyme inhibitors for skin disorders, antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-07-28 US disclosed
US-4786652-A TOPICAL ADMINISTRATION SYNTEX (U.S.A.) INC. (US) 1988-11-22 US disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed