SCHEMBL16720071

SCHEMBL16720071

O=C(O)c1ccc(-c2cc[c]cc2O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ CA12 O43570 3/20 0.42
▸ CA1 P00915 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ CA9 Q16790 3/20 0.42
▸ CA14 Q9ULX7 3/20 0.42
▸ CA4 P22748 2/20 0.42
▸ CA6 P23280 2/20 0.42
▸ CA7 P43166 2/20 0.42
▸ CA3 P07451 1/20 0.42
▸ TYR P14679 1/20 0.42
▸ DRD1 P21728 1/20 0.42
▸ CA5A P35218 1/20 0.42
▸ CA5B Q9Y2D0 1/20 0.42
▸ BCL2L1 Q07817 1/20 0.41
▸ BAD Q92934 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
SCHEMBL9768655 0.82 FOLH1 (0.47) TP53TSHRHSD17B10CA12CA1
SCHEMBL16720405 0.80 KMO (0.50) CA12CA1CA2CA9CA6
SCHEMBL159940 0.79 ALDH1A1 (0.54) KDM4EHSD17B10BCL2L1HDAC4HDAC2
SCHEMBL16719637 0.79 ESR1 (0.42) TP53KDM4ELMNAHSD17B10CA12
SCHEMBL16720203 0.76 ALOX5 (0.41) LMNAHSD17B10CA12CA9MAPT
SCHEMBL9988102 0.76 BACE1 (0.38) TP53HSD17B10CA12CA9BCL2L1
SCHEMBL6669375 0.76 PIK3CA (0.35) KDM4EHSD17B10CA9CA14CA6
SCHEMBL3238016 0.75 CA12 (0.61) TP53TSHRKDM4ELMNAHSD17B10
SCHEMBL29133892 0.74 TP53 (0.57) TP53TSHRKDM4ELMNAHSD17B10
SCHEMBL298629 0.74 BCL2L1 (0.58) TP53TSHRKDM4ELMNAHSD17B10

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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