SCHEMBL11767242

SCHEMBL11767242

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 9/20 0.49
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ PTGER1 P34995 1/20 0.47
▸ PTGER3 P43115 1/20 0.47
▸ PTGER2 P43116 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PTGDR Q13258 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ LTB4R Q15722 6/20 0.46
▸ AKR1B1 P15121 1/20 0.42
▸ LTB4R2 Q9NPC1 3/20 0.40
▸ TSHR P16473 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAOA P21397 1/20 0.38

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
SCHEMBL11767393 0.90 TTR (0.48) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11767577 0.89 KDM4E (0.55) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11768713 0.89 KDM4E (0.51) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11772423 0.89 LTB4R (0.53) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11767441 0.87 LTB4R (0.61) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11771214 0.87 TTR (0.55) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11769222 0.87 TTR (0.51) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11772196 0.86 KDM4E (0.50) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11765968 0.85 TTR (0.46) TTRKDM4EALDH1A1MEN1TP53
SCHEMBL11766644 0.85 TTR (0.49) TTRKDM4EALDH1A1MEN1TP53

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
Send feedback