SCHEMBL11230710

SCHEMBL11230710

[O]c1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.77
KMT2A Q03164 10/20 0.77
KDM4E B2RXH2 8/20 0.77
CYP3A4 P08684 7/20 0.77
HSD17B10 Q99714 7/20 0.77
ALOX15 P16050 7/20 0.77
MAPT P10636 7/20 0.77
RECQL P46063 6/20 0.77
CYP2C9 P11712 6/20 0.77
CYP1A2 P05177 6/20 0.77
XDH P47989 6/20 0.77
TP53 P04637 5/20 0.77
APP P05067 5/20 0.77
IPMK Q8NFU5 5/20 0.77
IP6K2 Q9UHH9 5/20 0.77
SLCO2B1 O94956 5/20 0.77
ALDH1A1 P00352 5/20 0.77
HPGD P15428 5/20 0.77
CYP1A1 P04798 5/20 0.77
CYP1B1 Q16678 5/20 0.77

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
Quercetin SCHEMBL27882581 0.87 MEN1 (0.94) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL118425 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL29723041 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL17629824 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL19723 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL29353785 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL31507620 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL29351036 0.87 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL6756842 0.86 MEN1 (0.97) MEN1KMT2AKDM4ECYP3A4HSD17B10
Quercetin SCHEMBL4815328 0.86 MEN1 (0.97) MEN1KMT2AKDM4ECYP3A4HSD17B10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4342752-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1982-08-03 US disclosed