SCHEMBL11768310

SCHEMBL11768310

CCCc1cc(S(=O)(=O)CCC)cc2c(=O)c3cc(C(=O)O)ccc3oc12

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.51
▸ TTR P02766 9/20 0.47
▸ LTB4R Q15722 6/20 0.45
▸ KMT2A Q03164 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ PTGER1 P34995 1/20 0.40
▸ PTGER3 P43115 1/20 0.40
▸ PTGER2 P43116 1/20 0.40
▸ PTGDR Q13258 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ LTB4R2 Q9NPC1 3/20 0.39
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.36

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
SCHEMBL11772669 0.94 AKR1B1 (0.53) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11772617 0.94 AKR1B1 (0.53) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11772500 0.92 LTB4R (0.51) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11769460 0.89 AKR1B1 (0.53) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11769810 0.89 AKR1B1 (0.53) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11767905 0.88 AKR1B1 (0.52) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11768925 0.88 AKR1B1 (0.52) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11768129 0.88 AKR1B1 (0.54) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11768032 0.87 TTR (0.53) AKR1B1TTRLTB4RKMT2AKDM4E
SCHEMBL11766482 0.87 AKR1B1 (0.50) AKR1B1TTRLTB4RKMT2AKDM4E

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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