SCHEMBL9146087

SCHEMBL9146087

CCN(CC)CCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccc(F)cc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKACA P17612 13/20 0.67
▸ PRKACG P22612 13/20 0.67
▸ PRKACB P22694 13/20 0.67
▸ CDK4 P11802 5/20 0.67
▸ CCND1 P24385 5/20 0.67
▸ CCNE2 O96020 3/20 0.67
▸ CCNE1 P24864 3/20 0.67
▸ CDK2 P24941 3/20 0.67
▸ CCNB2 O95067 3/20 0.67
▸ CDK1 P06493 3/20 0.67
▸ CCNB1 P14635 3/20 0.67
▸ CCNB3 Q8WWL7 3/20 0.67
▸ PRKD1 Q15139 2/20 0.67
▸ TDP1 Q9NUW8 2/20 0.67
▸ GSK3B P49841 2/20 0.67
▸ SIRT2 Q8IXJ6 2/20 0.67
▸ MEN1 O00255 1/20 0.67
▸ PRKD3 O94806 1/20 0.67
▸ TP53 P04637 1/20 0.67
▸ PRKCG P05129 1/20 0.67

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
SCHEMBL9087155 0.95 PRKACA (0.61) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL7815884 0.93 PRKACA (0.67) PRKACAPRKACGPRKACBCDK4CCND1
Hydrochloric Acid SCHEMBL9083051 0.92 PRKACA (0.66) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087353 0.91 PRKACA (0.81) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9082942 0.90 PRKACA (0.68) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL7826095 0.90 PRKACA (0.81) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087395 0.90 PRKACA (0.67) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085996 0.90 PRKACA (0.67) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087332 0.90 PRKACA (0.67) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085118 0.90 PRKACA (0.67) 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-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
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