SCHEMBL11766941

SCHEMBL11766941

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ TP53 P04637 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ PTGER1 P34995 1/20 0.39
▸ PTGER3 P43115 1/20 0.39
▸ PTGER2 P43116 1/20 0.39
▸ PTGDR Q13258 1/20 0.39
▸ NPC1 O15118 5/20 0.39
▸ RAB9A P51151 5/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 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
SCHEMBL11767290 0.89 TTR (0.50) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11865533 0.81 KDM4E (0.58) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11766947 0.78 NPC1 (0.40) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11766534 0.78 NPC1 (0.37) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL69937 0.77 NPC1 (0.58) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11765614 0.75 TTR (0.52) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11769033 0.73 ESR1 (0.44) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11769405 0.72 TTR (0.50) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11319698 0.72 KDM4E (0.56) KDM4EALDH1A1HPGDKMT2ATP53
SCHEMBL11319692 0.71 NPC1 (0.71) KDM4EALDH1A1HPGDKMT2ATP53

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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