SCHEMBL16720010

SCHEMBL16720010

Oc1ccc[c]c1-c1cnc2[nH]ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 4/20 0.55
▸ CDK8 P49336 11/20 0.54
▸ AXL P30530 1/20 0.54
▸ PIK3CD O00329 1/20 0.49
▸ PIK3CA P42336 1/20 0.49
▸ PIK3CB P42338 1/20 0.49
▸ PIK3CG P48736 1/20 0.49
▸ CDK7 P50613 2/20 0.47
▸ CCNT1 O60563 1/20 0.47
▸ CCND1 P24385 1/20 0.47
▸ CCNC P24863 1/20 0.47
▸ CDK9 P50750 1/20 0.47
▸ CCNH P51946 1/20 0.47
▸ MNAT1 P51948 1/20 0.47
▸ CDK6 Q00534 1/20 0.47
▸ PLK4 O00444 1/20 0.47
▸ DCLK1 O15075 1/20 0.47
▸ ROCK2 O75116 1/20 0.47
▸ PRKD3 O94806 1/20 0.47
▸ MAP4K4 O95819 1/20 0.47

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
SCHEMBL31064990 0.77 CDK8 (0.64) RIPK1CDK8AXLPIK3CDPIK3CA
SCHEMBL858203 0.77 CDK8 (0.64) RIPK1CDK8AXLPIK3CDPIK3CA
SCHEMBL16719750 0.75 NPC1 (0.50) —
SCHEMBL4831501 0.75 CDK8 (0.81) RIPK1CDK8AXLPIK3CDPIK3CA
SCHEMBL16720494 0.72 TYR (0.46) BTK
SCHEMBL16720660 0.72 BRD4 (0.38) AXLNUDT1
SCHEMBL27699368 0.72 CDK8 (0.67) RIPK1CDK8AXLPIK3CDPIK3CA
SCHEMBL16720011 0.72 RIPK1 (0.55) RIPK1CDK8AXLPIK3CDPIK3CA
SCHEMBL296946 0.71 RIPK1 (0.66) RIPK1CDK8AXLPIK3CDPIK3CA
SCHEMBL22978455 0.71 RIPK1 (1.00) RIPK1CDK8AXLPIK3CDPIK3CA

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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