SCHEMBL11766534

SCHEMBL11766534

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.37
▸ RAB9A P51151 5/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ AKR1B1 P15121 1/20 0.36
▸ KMT2A Q03164 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ TP53 P04637 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ PTGER1 P34995 1/20 0.35
▸ PTGER3 P43115 1/20 0.35
▸ PTGER2 P43116 1/20 0.35

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
SCHEMBL11865140 0.82 KMT2A (0.55) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL11766941 0.78 KDM4E (0.39) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL11766947 0.76 NPC1 (0.40) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL69937 0.74 NPC1 (0.58) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL11769033 0.71 ESR1 (0.44) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL21385340 0.71 MAPT (0.58) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL29594225 0.71 MAPT (0.58) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL11768775 0.70 AKR1B1 (0.36) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL11765614 0.70 TTR (0.52) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL11769405 0.70 TTR (0.50) NPC1RAB9AKDM4EALDH1A1HPGD

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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