SCHEMBL5778475

SCHEMBL5778475

COc1ccc(CNc2nc(-c3ccncc3)nc3sc4c(c23)CCCC4)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 20/20 0.62

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
SCHEMBL5782107 0.92 PRKCI (0.65) PRKCI
SCHEMBL7513676 0.91 PRKCI (0.59) PRKCI
SCHEMBL5780971 0.90 KDM4E (0.54) PRKCI
SCHEMBL5782433 0.89 PRKCI (0.66) PRKCI
SCHEMBL8172960 0.88 LMNA (0.49) PRKCI
SCHEMBL7015020 0.88 PTGS2 (0.51) PRKCI
SCHEMBL6707189 0.88 PDE4B (0.51) PRKCI
SCHEMBL7169369 0.87 KDM4E (0.51) PRKCI
SCHEMBL5780526 0.86 PRKCI (0.49) PRKCI
SCHEMBL7404512 0.86 MAPT (0.53) PRKCI

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
EP-1685136-A1 USE OF THIENOPYRIMIDINES MERCK PATENT GmbH (DE) 2006-08-02 EP disclosed
WO-2005047292-A1 USE OF THIENOPYRIMIDINES MERCK PATENT GMBH (DE) 2005-05-26 WO disclosed
US-6110920-A TREATMENT OF CARDIOVASCULAR DISORDERS AND IMPOTENCY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-08-29 US disclosed
EP-0920431-A1 THIENOPYRIMIDINES MERCK PATENT GmbH (DE) 1999-06-09 EP disclosed
WO-1998006722-A1 THIENOPYRIMIDINES MERCK PATENT GMBH (DE) 1998-02-19 WO disclosed