SCHEMBL9086540

SCHEMBL9086540

NCCCn1cc(C2=C(c3c[nH]c4ccc(OCc5ccccc5)cc34)C(=O)NC2=O)c2cc(OCc3ccccc3)ccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 12/20 0.64
PRKACA P17612 6/20 0.64
PRKACG P22612 6/20 0.64
PRKACB P22694 6/20 0.64
PRKD1 Q15139 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
CDK4 P11802 3/20 0.52
CCND1 P24385 3/20 0.52
RPS6KB1 P23443 1/20 0.51
PIM1 P11309 2/20 0.50
MAPT P10636 2/20 0.49
MEN1 O00255 1/20 0.49
PRKD3 O94806 1/20 0.49
CCNB2 O95067 1/20 0.49
CCNE2 O96020 1/20 0.49
TP53 P04637 1/20 0.49
PRKCG P05129 1/20 0.49
CYP1A2 P05177 1/20 0.49
PRKCB P05771 1/20 0.49
CDK1 P06493 1/20 0.49

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
SCHEMBL9086512 0.96 CAMK2D (0.70) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9083919 0.96 CAMK2D (0.57) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9087600 0.91 PRKACA (0.64) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9087990 0.91 PRKACA (0.63) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9087584 0.89 PRKD1 (0.73) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9085295 0.89 PRKACA (0.65) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9086146 0.89 CAMK2D (0.70) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9088317 0.88 PRKD1 (0.62) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9085655 0.88 PRKD1 (0.56) CAMK2DPRKACAPRKACGPRKACBPRKD1
SCHEMBL9084923 0.88 PRKACA (0.56) CAMK2DPRKACAPRKACGPRKACBPRKD1

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