SCHEMBL11767290

SCHEMBL11767290

O=C(O)c1ccc2oc3c(OC=S)cc(OC=S)cc3c(=O)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 10/20 0.50
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ PTGER1 P34995 1/20 0.47
▸ PTGER3 P43115 1/20 0.47
▸ PTGER2 P43116 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PTGDR Q13258 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ AKR1B1 P15121 1/20 0.43
▸ LTB4R Q15722 4/20 0.42
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ IKBKE Q14164 1/20 0.37
▸ TBK1 Q9UHD2 1/20 0.37
▸ MAPT P10636 1/20 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
SCHEMBL11766941 0.89 KDM4E (0.39) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11765614 0.81 TTR (0.52) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11862640 0.79 ALDH1A1 (0.70) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11768887 0.78 KMT2A (0.67) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11768716 0.78 TTR (0.52) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11767299 0.78 TTR (0.49) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11766934 0.78 TTR (0.52) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11768898 0.76 LTB4R (0.56) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11868704 0.75 KDM4E (0.61) TTRKDM4EALDH1A1HPGDMEN1
SCHEMBL11768779 0.75 KDM4E (0.52) TTRKDM4EALDH1A1HPGDMEN1

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 8 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
US-3951618-A Method of use of, and compositions containing, disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-04-20 — — US disclosed
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