SCHEMBL11766977

SCHEMBL11766977

Cc1cc(C(C)OC(C)C)c2oc3ccc(C(=O)O)cc3c(=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ HPGD P15428 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ TP53 P04637 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ PTGER1 P34995 1/20 0.53
▸ PTGER3 P43115 1/20 0.53
▸ PTGER2 P43116 1/20 0.53
▸ PTGDR Q13258 1/20 0.53
▸ TTR P02766 9/20 0.47
▸ LTB4R Q15722 5/20 0.45
▸ AKR1B1 P15121 1/20 0.43
▸ LTB4R2 Q9NPC1 2/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ PKM P14618 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
SCHEMBL11771210 0.90 KDM4E (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11769512 0.90 KDM4E (0.54) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11765568 0.88 KDM4E (0.49) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11769420 0.86 TTR (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11771174 0.82 TTR (0.52) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11767771 0.80 TTR (0.65) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11769229 0.79 TTR (0.53) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11773034 0.79 KDM4E (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11770119 0.78 KDM4E (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL11767881 0.78 KDM4E (0.62) KDM4EALDH1A1HPGDMEN1KMT2A

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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