SCHEMBL9084864

SCHEMBL9084864

Cc1ccc2c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)cn(CCCO)c2c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 10/20 0.80
PRKACG P22612 10/20 0.80
PRKACB P22694 10/20 0.80
CDK4 P11802 4/20 0.80
CCND1 P24385 4/20 0.80
CAMK2D Q13557 4/20 0.64
CCNB2 O95067 3/20 0.64
CDK1 P06493 3/20 0.64
CCNB1 P14635 3/20 0.64
CCNB3 Q8WWL7 3/20 0.64
GSK3B P49841 3/20 0.64
CCNE2 O96020 2/20 0.64
CCNE1 P24864 2/20 0.64
CDK2 P24941 2/20 0.64
PRKD1 Q15139 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
MEN1 O00255 1/20 0.64
PRKD3 O94806 1/20 0.64
TP53 P04637 1/20 0.64
PRKCG P05129 1/20 0.64

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
SCHEMBL9088128 0.92 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086912 0.90 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086155 0.89 PRKACA (0.81) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9088970 0.89 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL8074668 0.89 PRKACA (1.00) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086181 0.89 PRKACA (0.82) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087576 0.89 PRKACA (0.77) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085605 0.89 PRKACA (0.77) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086320 0.89 PRKACA (0.82) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087077 0.89 PRKACA (0.80) 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 2 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