SCHEMBL11770193

SCHEMBL11770193

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PTGER1 P34995 1/20 0.38
▸ PTGER3 P43115 1/20 0.38
▸ PTGER2 P43116 1/20 0.38
▸ PTGDR Q13258 1/20 0.38
▸ TTR P02766 3/20 0.36
▸ THRB P10828 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ NQO2 P16083 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
SCHEMBL11765568 0.89 KDM4E (0.49) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL11767358 0.87 NPC1 (0.41) NPC1RAB9ARXFP1MEN1KMT2A
SCHEMBL11771210 0.81 KDM4E (0.51) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL11770716 0.80 NPC1 (0.46) NPC1RAB9ARXFP1MEN1KMT2A
SCHEMBL11766797 0.80 ALDH1A1 (0.40) NPC1RAB9ARXFP1MEN1KMT2A
SCHEMBL11767924 0.79 ALDH1A1 (0.50) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL11765558 0.79 KDM4E (0.49) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL11767060 0.78 KDM4E (0.48) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL11766977 0.78 KDM4E (0.53) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL11770387 0.76 ALDH1A1 (0.40) NPC1RAB9AMEN1KMT2AKDM4E

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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