SCHEMBL9086535

SCHEMBL9086535

CN(C)CCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2cc(N)ccc21

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 11/20 0.81
PRKACG P22612 11/20 0.81
PRKACB P22694 11/20 0.81
PRKCA P17252 6/20 0.81
CDK4 P11802 3/20 0.81
CCND1 P24385 3/20 0.81
PRKCB P05771 3/20 0.81
PRKCH P24723 3/20 0.81
PRKCQ Q04759 3/20 0.81
PRKCD Q05655 3/20 0.81
PRKD1 Q15139 2/20 0.81
TDP1 Q9NUW8 2/20 0.81
PIM1 P11309 2/20 0.81
PRKCE Q02156 2/20 0.81
GSK3B P49841 2/20 0.81
CCNB2 O95067 2/20 0.81
CDK1 P06493 2/20 0.81
CCNB1 P14635 2/20 0.81
CCNB3 Q8WWL7 2/20 0.81
MEN1 O00255 1/20 0.81

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
SCHEMBL9088096 0.94 PRKACA (0.71) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL9085100 0.94 PRKACA (0.69) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL9088590 0.93 PRKACA (0.81) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL9087626 0.91 PRKACA (0.67) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL9087076 0.90 PRKACA (0.82) PRKACAPRKACGPRKACBPRKCACDK4
Gf-109203 SCHEMBL338086 0.90 PRKACA (1.00) PRKACAPRKACGPRKACBPRKCACDK4
Gf-109203 SCHEMBL29353725 0.90 PRKACA (1.00) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL9084210 0.89 PRKACA (0.81) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL9087334 0.89 PRKACA (0.81) PRKACAPRKACGPRKACBPRKCACDK4
SCHEMBL7822724 0.89 PRKACA (0.81) PRKACAPRKACGPRKACBPRKCACDK4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516915-A Bis-(1H-indol-3-yl)-maleinimide derivatives, processes for the preparation thereof and pharmaceutical compositions containing them GOEDECKE AKTIENGESELLSCHAFT (DE) 1996-05-14 US disclosed
US-5380746-A Bis-(1H-indol-3-YL)-maleinimide derivatives, processes for the preparation thereof and pharmaceutical compositions containing them GOEDECKE AKTIENGESELLSCHAFT (DE) 1995-01-10 US disclosed
EP-0397060-A2 Maleinimide derivatives and their use as medicines GÖDECKE AKTIENGESELLSCHAFT (DE) 1990-11-14 EP disclosed