SCHEMBL11767263

SCHEMBL11767263

CCCCCCCCCCCCOc1cc([S+](C)[O-])cc2c(=O)c3cc(C(=O)OC)ccc3oc12

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 9/20 0.53
▸ LTB4R2 Q9NPC1 3/20 0.39
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ TTR P02766 1/20 0.38
▸ SMPD1 P17405 3/20 0.37
▸ PGAM1 P18669 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36

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
SCHEMBL11772429 1.00 LTB4R (0.53) LTB4RLTB4R2MAOAMAOBTTR
SCHEMBL11769318 1.00 LTB4R (0.53) LTB4RLTB4R2MAOAMAOBTTR
SCHEMBL11770406 1.00 LTB4R (0.53) LTB4RLTB4R2MAOAMAOBTTR
SCHEMBL11770565 0.93 LTB4R (0.53) LTB4RLTB4R2TTRALDH1A1
SCHEMBL11769757 0.93 LTB4R (0.53) LTB4RLTB4R2TTRALDH1A1
SCHEMBL11771441 0.93 LTB4R (0.61) LTB4RLTB4R2TTRALDH1A1HPGD
SCHEMBL11767597 0.93 LTB4R (0.61) LTB4RLTB4R2TTRALDH1A1HPGD
SCHEMBL11771348 0.93 LTB4R (0.61) LTB4RLTB4R2TTRALDH1A1HPGD
SCHEMBL11769199 0.93 LTB4R (0.61) LTB4RLTB4R2TTRALDH1A1HPGD
SCHEMBL11767805 0.92 LTB4R (0.52) LTB4RLTB4R2TTRPGAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3989721-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-11-02 — — US disclosed
US-3989720-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-11-02 — — US disclosed
US-3988352-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-10-26 — — US disclosed
US-3979414-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-09-07 — — US disclosed
US-3965115-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-22 — — US disclosed
US-3963753-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-15 — — US disclosed
US-3963752-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-15 — — US disclosed
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