SCHEMBL11770253

SCHEMBL11770253

CCOc1cc(C(C)O)cc2c(=O)c3cc(C(=O)O)ccc3oc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ PTGER1 P34995 1/20 0.48
▸ PTGER3 P43115 1/20 0.48
▸ PTGER2 P43116 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ PTGDR Q13258 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ TTR P02766 11/20 0.48
▸ LTB4R Q15722 6/20 0.48
▸ AKR1B1 P15121 1/20 0.42
▸ LTB4R2 Q9NPC1 3/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NPC1 O15118 1/20 0.39
▸ ABCC4 O15439 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL11773121 0.92 LTB4R (0.53) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11767393 0.92 TTR (0.48) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11767785 0.90 LTB4R (0.61) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11768713 0.88 KDM4E (0.51) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11767129 0.87 KDM4E (0.58) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11769097 0.86 TTR (0.51) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11768525 0.84 TTR (0.52) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11768716 0.84 TTR (0.52) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11769018 0.84 TTR (0.52) KDM4EMEN1ALDH1A1TP53CYP2C9
SCHEMBL11767468 0.84 TTR (0.51) KDM4EMEN1ALDH1A1TP53CYP2C9

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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