SCHEMBL2442013

SCHEMBL2442013

Cc1ccc(Nc2ccnc3[nH]c4c(c23)CN(CC=O)CC4)cc1F

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTK6 Q13882 2/20 0.41
AURKA O14965 14/20 0.40
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL2438052 0.87 AURKA (0.46) AURKA
SCHEMBL2434184 0.84 AURKA (0.40) PTK6AURKAKDM4E
SCHEMBL2434736 0.84 AURKA (0.40) PTK6AURKAKDM4E
SCHEMBL407838 0.82 BAZ2B (0.46) PTK6AURKAMAPT
SCHEMBL408059 0.76 AURKA (0.49) PTK6AURKA
Hydrochloric Acid SCHEMBL403430 0.75 AURKA (0.49) PTK6AURKA
SCHEMBL405109 0.69 CREBBP (0.59) AURKAMAPT
SCHEMBL407222 0.68 CREBBP (0.61) AURKAMAPT
SCHEMBL407376 0.66 BAZ2B (0.47) MAPT
SCHEMBL407556 0.66 BAZ2B (0.47) PTK6MAPT

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-2367822-A1 TRICYCLIC AZAINDOLES Merck Patent GmbH (DE) 2011-09-28 EP claimed
WO-2010080253-A1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2010-07-15 WO claimed