SCHEMBL16720374

SCHEMBL16720374

Cc1cccc(-c2cc[c]cc2O)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.51
CNR1 P21554 5/20 0.51
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
ACHE P22303 2/20 0.39
ABCB1 P08183 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RPS6KA3 P51812 1/20 0.38
ACLY P53396 1/20 0.38
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL16719582 0.82 HSD17B1 (0.47) CA12CA9
SCHEMBL5634702 0.82 ACHE (0.39) CNR2CNR1ACHE
SCHEMBL1045097 0.79 AKR1C3 (0.44) CNR2CNR1ACHERPS6KA3
SCHEMBL16719911 0.79 ALOX5 (0.49) CA12CA9ALOX15ALOX12
SCHEMBL16720132 0.79 ESR2 (0.46) ALOX15ALOX12MAPTTHRB
SCHEMBL2377419 0.79 HDAC4 (0.50) CNR2CNR1ABCB1RPS6KA3ACLY
SCHEMBL16719963 0.79 CNR2 (0.41) CNR2CNR1ALOX15ALOX12
SCHEMBL9988102 0.78 BACE1 (0.38) CA12CA9ALOX15ALOX12ACHE
SCHEMBL29035128 0.77 CNR2 (0.60) CNR2CNR1CA12CA9ALOX15
SCHEMBL159940 0.77 ALDH1A1 (0.54) CNR2CNR1MAPT

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