SCHEMBL20172118

SCHEMBL20172118

Nc1ccc2c(c1)N(c1ccccc1)c1cnc(Nc3ccc4c(c3)Oc3ccncc3N4c3ccccc3)cc1O2

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 8/20 0.38
RHOA P61586 1/20 0.32
GNG2 P59768 1/20 0.31
GNB1 P62873 1/20 0.31

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
SCHEMBL17490039 0.83 CDK8 (0.37) CDK8
SCHEMBL20172233 0.81 GNG2 (0.40) CDK8GNG2GNB1
SCHEMBL17490203 0.78 PIM1 (0.37) CDK8
SCHEMBL21415084 0.76 CDK8 (0.38) CDK8GNG2GNB1
SCHEMBL29214105 0.75 MAPT (0.40) CDK8
SCHEMBL17489707 0.75 CDK8 (0.38) CDK8
SCHEMBL20308279 0.72 ALDH1A1 (0.38) CDK8
SCHEMBL20307931 0.72 NPC1 (0.45)
SCHEMBL20308278 0.71 CDK8 (0.37) CDK8
SCHEMBL10043567 0.69 MAPT (0.45) CDK8

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
EP-2980182-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2018-05-23 EP disclosed