SCHEMBL3715751

SCHEMBL3715751

NC(=O)CCn1cc(Br)c2cnc(Cl)nc21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.34
▸ PDE4A P27815 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ CNR2 P34972 1/20 0.30
▸ GRM2 Q14416 1/20 0.30

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
SCHEMBL3713447 0.86 LRRK2 (0.38) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL3715755 0.80 GSK3B (0.32) —
SCHEMBL27844380 0.79 — —
SCHEMBL3712173 0.74 LMNA (0.49) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL15163200 0.72 CDK4 (0.46) CNR2
SCHEMBL14842103 0.71 ALDH1A1 (0.41) KDM4E
SCHEMBL30955629 0.70 LRRK2 (0.38) —
SCHEMBL24151605 0.68 MCL1 (0.39) PDE4BPDE4D
SCHEMBL25194791 0.67 DGAT1 (0.42) —
SCHEMBL25559827 0.66 ABL1 (0.31) —

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
EP-2403853-B1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RES COUNCIL TECHNOLOGY (GB) 2013-08-14 — — EP disclosed
WO-2010100431-A1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-09-10 — — WO disclosed
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