SCHEMBL16720405

SCHEMBL16720405

O=C(O)c1cccc(-c2cc[c]cc2O)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.50
▸ ERN1 O75460 1/20 0.47
▸ RXRA P19793 2/20 0.45
▸ RXRB P28702 2/20 0.45
▸ DDT P30046 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ FOLH1 Q04609 2/20 0.43
▸ KEAP1 Q14145 1/20 0.43
▸ AKR1C3 P42330 1/20 0.42
▸ AKR1C2 P52895 1/20 0.42
▸ GPR35 Q9HC97 1/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ CD74 P04233 1/20 0.41
▸ MIF P14174 1/20 0.41
▸ PTGER1 P34995 1/20 0.41

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
SCHEMBL16720071 0.80 TP53 (0.43) ERN1RXRARXRBCA12CA1
SCHEMBL16719582 0.78 HSD17B1 (0.47) CA12CA2CA9
SCHEMBL442496 0.78 KMO (0.63) KMOERN1RXRARXRBDDT
SCHEMBL159940 0.77 ALDH1A1 (0.54) CNR2
SCHEMBL4171236 0.77 ALOX5 (0.60) KMOERN1RXRARXRBDDT
Hydrochloric Acid SCHEMBL27574419 0.77 KMO (0.61) KMOERN1RXRARXRBDDT
SCHEMBL1510125 0.77 KMO (0.61) KMOERN1RXRARXRBCA12
SCHEMBL695112 0.76 KMO (0.71) KMOERN1RXRARXRBCA12
SCHEMBL16719911 0.76 ALOX5 (0.49) CA12CA9MIF
SCHEMBL16720374 0.76 CNR2 (0.51) CA12CA9CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 — — EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 — — WO disclosed
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