SCHEMBL11767218

SCHEMBL11767218

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

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 7/20 0.62
▸ TTR P02766 4/20 0.46
▸ LTB4R2 Q9NPC1 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ TP53 P04637 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL11765543 1.00 LTB4R (0.62) LTB4RTTRLTB4R2ALDH1A1HPGD
SCHEMBL11767465 1.00 LTB4R (0.62) LTB4RTTRLTB4R2ALDH1A1HPGD
SCHEMBL11772690 0.99 LTB4R (0.60) LTB4RTTRLTB4R2ALDH1A1HPGD
SCHEMBL11767654 0.97 LTB4R (0.58) LTB4RTTRLTB4R2ALDH1A1HPGD
SCHEMBL11768632 0.94 LTB4R (0.54) LTB4RTTRLTB4R2ALDH1A1HPGD
SCHEMBL11766696 0.91 LTB4R (0.52) LTB4RTTRLTB4R2
SCHEMBL11766512 0.91 LTB4R (0.52) LTB4RLTB4R2ALDH1A1
SCHEMBL11767463 0.91 LTB4R (0.52) LTB4RTTRLTB4R2
SCHEMBL11766508 0.91 LTB4R (0.52) LTB4RTTRLTB4R2
SCHEMBL11774766 0.91 LTB4R (0.52) LTB4RTTRLTB4R2

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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