SCHEMBL8074668

SCHEMBL8074668

O=C1NC(=O)C(c2cn(CCCO)c3ccccc23)=C1c1c[nH]c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 10/20 1.00
PRKACG P22612 10/20 1.00
PRKACB P22694 10/20 1.00
CDK4 P11802 4/20 1.00
CCND1 P24385 4/20 1.00
CAMK2D Q13557 4/20 0.80
CCNB2 O95067 3/20 0.77
CDK1 P06493 3/20 0.77
CCNB1 P14635 3/20 0.77
CCNB3 Q8WWL7 3/20 0.77
GSK3B P49841 2/20 0.76
CCNE2 O96020 2/20 0.76
CCNE1 P24864 2/20 0.76
CDK2 P24941 2/20 0.76
PRKCB P05771 2/20 0.76
PRKCA P17252 2/20 0.76
PRKCE Q02156 2/20 0.76
MEN1 O00255 1/20 0.76
PRKD3 O94806 1/20 0.76
TP53 P04637 1/20 0.76

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
SCHEMBL9087173 0.90 PRKACA (0.81) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086155 0.90 PRKACA (0.81) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL7873644 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087225 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087077 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9088128 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086653 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9086437 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9085385 0.89 PRKACA (0.80) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9088315 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6133452-A REACTION OF OPTIONALLY SUBSTITUTED INDOLE-3-ACETAMIDES WITH OPTIONALLY SUBSTITUTED METHYL INDOLE-3-GLYOXYL REAGENT TO PREPARE POTENT PKC INHIBITORS ELI LILLY AND COMPANY (US) 2000-10-17 US disclosed
US-5990319-A REACTING INDOLYL-3-ACETAMIDE WITH INDOLYL-3-GLYOXYL REAGENT ELI LILLY AND COMPANY (US) 1999-11-23 US disclosed
EP-0825190-A1 Synthesis of bisindolymaleimides ELI LILLY AND COMPANY (US) 1998-02-25 EP disclosed
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