SCHEMBL11768650

SCHEMBL11768650

Cc1ccc2oc3ccc(C(=O)O)cc3c(=O)c2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 8/20 0.69
AKR1B1 P15121 1/20 0.60
KDM4E B2RXH2 6/20 0.59
ALDH1A1 P00352 4/20 0.59
HPGD P15428 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
HSD17B10 Q99714 2/20 0.59
TP53 P04637 2/20 0.59
CYP2C9 P11712 2/20 0.59
PTGER1 P34995 1/20 0.59
PTGER3 P43115 1/20 0.59
PTGER2 P43116 1/20 0.59
PTGDR Q13258 1/20 0.59
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
PKM P14618 1/20 0.57
MAPT P10636 4/20 0.56
HTT P42858 1/20 0.56

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
SCHEMBL2628175 0.92 TTR (0.70) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL68189 0.90 TTR (0.83) TTRAKR1B1KDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL11749391 0.88 TTR (0.81) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11883817 0.85 NPC1 (0.74) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11859861 0.84 TTR (0.64) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL1611070 0.84 ALPG (0.59) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL27147943 0.84 TTR (0.53) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11767771 0.84 TTR (0.65) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11322640 0.83 TTR (0.80) TTRAKR1B1KDM4EALDH1A1HPGD
SCHEMBL14124820 0.83 SRD5A2 (0.58) TTRAKR1B1KDM4EALDH1A1HPGD

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