SCHEMBL11766508

SCHEMBL11766508

CCCCCCCCCCCCOc1cc(SC)cc2c(=O)c3cc(C(=O)OC)ccc3oc12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 6/20 0.52
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ SMPD1 P17405 4/20 0.39
▸ LTB4R2 Q9NPC1 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ PGAM1 P18669 1/20 0.38
▸ THRA P10827 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ TTR P02766 1/20 0.37
▸ MGLL Q99685 2/20 0.37

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
SCHEMBL11767463 1.00 LTB4R (0.52) LTB4RMAOAMAOBSMPD1LTB4R2
SCHEMBL11766696 1.00 LTB4R (0.52) LTB4RMAOAMAOBSMPD1LTB4R2
SCHEMBL11774766 1.00 LTB4R (0.52) LTB4RMAOAMAOBSMPD1LTB4R2
SCHEMBL11767315 0.93 LTB4R (0.52) LTB4RLTB4R2NPC1RAB9APGAM1
SCHEMBL11766512 0.93 LTB4R (0.52) LTB4RLTB4R2NPC1RAB9APGAM1
SCHEMBL11768877 0.92 LTB4R (0.51) LTB4RLTB4R2NPC1RAB9ARXFP1
SCHEMBL11769105 0.92 LTB4R (0.51) LTB4RLTB4R2NPC1RAB9ARXFP1
SCHEMBL11771151 0.92 LTB4R (0.51) LTB4RLTB4R2NPC1RAB9ARXFP1
SCHEMBL11765543 0.91 LTB4R (0.62) LTB4RLTB4R2TTR
SCHEMBL11767218 0.91 LTB4R (0.62) 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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