SCHEMBL11771324

SCHEMBL11771324

CC(=O)c1cc(OC(C)C)c2oc3ccc(C(=O)O)cc3c(=O)c2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.61
▸ KDM4E B2RXH2 2/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ MEN1 O00255 1/20 0.61
▸ TP53 P04637 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ HPGD P15428 1/20 0.61
▸ PTGER1 P34995 1/20 0.61
▸ PTGER3 P43115 1/20 0.61
▸ PTGER2 P43116 1/20 0.61
▸ PTGDR Q13258 1/20 0.61
▸ TTR P02766 9/20 0.49
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ AKR1B1 P15121 1/20 0.45
▸ LTB4R Q15722 4/20 0.44
▸ LTB4R2 Q9NPC1 1/20 0.43
▸ IKBKE Q14164 1/20 0.41
▸ TBK1 Q9UHD2 1/20 0.41

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
SCHEMBL11772075 0.89 NPC1 (0.49) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11768887 0.88 KMT2A (0.67) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11768414 0.88 KDM4E (0.57) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11770191 0.87 TTR (0.52) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11767129 0.86 KDM4E (0.58) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11781104 0.86 KDM4E (0.55) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11769425 0.85 KDM4E (0.57) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11769276 0.85 KDM4E (0.54) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11785257 0.84 KDM4E (0.56) KMT2AKDM4EALDH1A1HSD17B10MEN1
SCHEMBL11767432 0.84 KDM4E (0.56) KMT2AKDM4EALDH1A1HSD17B10MEN1

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-3963753-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-15 — — US claimed
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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