SCHEMBL11767805

SCHEMBL11767805

CCCCCCOc1cc([S+](C)[O-])cc2c(=O)c3cc(C(=O)OCC)ccc3oc12

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 9/20 0.52
▸ LTB4R2 Q9NPC1 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ TTR P02766 1/20 0.37
▸ CSF1R P07333 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ PGAM1 P18669 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
SCHEMBL11770531 1.00 LTB4R (0.52) LTB4RLTB4R2NPC1RAB9ARXFP1
SCHEMBL11771031 1.00 LTB4R (0.52) LTB4RLTB4R2NPC1RAB9ARXFP1
SCHEMBL11770565 0.95 LTB4R (0.53) LTB4RLTB4R2NPC1RAB9ATTR
SCHEMBL11769757 0.95 LTB4R (0.53) LTB4RLTB4R2NPC1RAB9ATTR
SCHEMBL11772429 0.92 LTB4R (0.53) LTB4RLTB4R2TTRPGAM1
SCHEMBL11770406 0.92 LTB4R (0.53) LTB4RLTB4R2TTRPGAM1
SCHEMBL11767263 0.92 LTB4R (0.53) LTB4RLTB4R2TTRPGAM1
SCHEMBL11769318 0.92 LTB4R (0.53) LTB4RLTB4R2TTRPGAM1
SCHEMBL11767597 0.92 LTB4R (0.61) LTB4RLTB4R2TTR
SCHEMBL11771348 0.92 LTB4R (0.61) LTB4RLTB4R2TTR

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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