SCHEMBL3959789

SCHEMBL3959789

O=C1NC(=O)C(c2cc3ccccc3[nH]2)=C1c1cc2ccccc2[nH]1.[Pb]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 6/20 0.61
PRKCG P05129 6/20 0.61
PRKCB P05771 6/20 0.61
PRKCA P17252 6/20 0.61
PRKCH P24723 6/20 0.61
PRKCI P41743 6/20 0.61
PRKCE Q02156 6/20 0.61
PRKCQ Q04759 6/20 0.61
PRKCZ Q05513 6/20 0.61
PRKCD Q05655 6/20 0.61
PRKD1 Q15139 6/20 0.61
PRKACA P17612 2/20 0.61
PRKACG P22612 2/20 0.61
PRKACB P22694 2/20 0.61
KDR P35968 2/20 0.56
CHEK1 O14757 1/20 0.56
RAB9A P51151 4/20 0.53
NPC1 O15118 4/20 0.53
KDM4E B2RXH2 3/20 0.47
MAPT P10636 3/20 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
SCHEMBL29415921 0.98 PRKD3 (0.62) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL78989 0.98 PRKD3 (0.62) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL3148480 0.90 NPC1 (0.61) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL31615194 0.90 NPC1 (0.61) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL3908537 0.86 PRKD3 (0.59) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL6417753 0.86 PRKD3 (0.56) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL12424814 0.84 KDR (0.54) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL2986726 0.83 PRKD3 (0.53) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL3257968 0.82 PRKD3 (0.49) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL15758300 0.81 PRKCB (0.64) PRKD3PRKCGPRKCBPRKCAPRKCH

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
WO-2009034464-A2 INDOLE RELATED COMPOUNDS WITH PHYSIOLOGICAL ACTIVITY NEWCASTLE INNOVATION LIMITED (AU) 2009-03-19 WO disclosed