SCHEMBL11769215

SCHEMBL11769215

CCCCCCOc1cc(S(C)(=O)=O)c2oc3ccc(C(=O)OCCCCC)cc3c(=O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 2/20 0.47
▸ STS P08842 7/20 0.43
▸ THRA P10827 2/20 0.40
▸ THRB P10828 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ACSL1 P33121 2/20 0.40
▸ ACSL6 Q9UKU0 2/20 0.40

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
SCHEMBL11769309 1.00 LTB4R (0.47) LTB4RSTSTHRATHRBNPC1
SCHEMBL11768072 0.95 LTB4R (0.47) LTB4RSTSTHRATHRBNPC1
SCHEMBL11770985 0.95 LTB4R (0.47) LTB4RSTSTHRATHRBNPC1
SCHEMBL11770534 0.95 LTB4R (0.47) LTB4RSTSTHRATHRBNPC1
SCHEMBL11766498 0.93 LTB4R (0.47) LTB4RTHRATHRBACSL1ACSL6
SCHEMBL11772354 0.93 LTB4R (0.47) LTB4RTHRATHRBACSL1ACSL6
SCHEMBL11768821 0.93 LTB4R (0.47) LTB4RTHRATHRBACSL1ACSL6
SCHEMBL11767527 0.93 LTB4R (0.47) LTB4RTHRATHRBACSL1ACSL6
SCHEMBL11768768 0.92 LTB4R (0.56) LTB4RALDH1A1ACSL1ACSL6
SCHEMBL11767174 0.92 LTB4R (0.56) LTB4RALDH1A1ACSL1ACSL6

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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