SCHEMBL11769018

SCHEMBL11769018

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 8/20 0.52
▸ LTB4R Q15722 4/20 0.51
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ LTB4R2 Q9NPC1 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PTGER1 P34995 1/20 0.46
▸ PTGER3 P43115 1/20 0.46
▸ PTGER2 P43116 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ PTGDR Q13258 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ AKR1B1 P15121 1/20 0.45
▸ CREBBP Q92793 3/20 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
SCHEMBL11769100 0.91 LTB4R (0.56) TTRLTB4RNPC1RAB9ALTB4R2
SCHEMBL11769097 0.90 TTR (0.51) TTRLTB4RNPC1RAB9ALTB4R2
SCHEMBL11769263 0.89 LTB4R (0.65) TTRLTB4RNPC1RAB9ALTB4R2
SCHEMBL11493784 0.89 LTB4R (0.52) TTRLTB4RNPC1RAB9ALTB4R2
SCHEMBL11768716 0.88 TTR (0.52) TTRLTB4RLTB4R2TSHRKDM4E
SCHEMBL11770191 0.87 TTR (0.52) TTRLTB4RNPC1RAB9ALTB4R2
SCHEMBL11774953 0.85 TTR (0.49) TTRLTB4RNPC1RAB9ALTB4R2
SCHEMBL11770899 0.84 AKR1B1 (0.52) TTRLTB4RLTB4R2TSHRKDM4E
SCHEMBL11767393 0.84 TTR (0.48) TTRLTB4RLTB4R2TSHRKDM4E
SCHEMBL11771763 0.84 TTR (0.48) TTRLTB4RNPC1RAB9ALTB4R2

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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