SCHEMBL9084351

SCHEMBL9084351

CN(C)CCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccc(N(C)C)cc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 11/20 0.72
PRKACG P22612 11/20 0.72
PRKACB P22694 11/20 0.72
CDK4 P11802 4/20 0.72
CCND1 P24385 4/20 0.72
CCNB2 O95067 3/20 0.72
CDK1 P06493 3/20 0.72
CCNB1 P14635 3/20 0.72
CCNB3 Q8WWL7 3/20 0.72
GSK3B P49841 3/20 0.72
PRKCA P17252 3/20 0.72
PRKD1 Q15139 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
CCNE2 O96020 2/20 0.72
CCNE1 P24864 2/20 0.72
CDK2 P24941 2/20 0.72
SIRT2 Q8IXJ6 2/20 0.72
PIM1 P11309 2/20 0.72
PRKCB P05771 2/20 0.72
MEN1 O00255 1/20 0.72

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
SCHEMBL9087451 0.94 PRKACA (0.82) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086764 0.93 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085004 0.92 PRKACA (0.64) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086092 0.91 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087435 0.91 PRKACA (0.68) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085988 0.90 PRKACA (0.72) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL7823516 0.90 PRKACA (0.88) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085660 0.90 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087325 0.90 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087907 0.90 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1

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