SCHEMBL170259

SCHEMBL170259

c1ncc2c(n1)SCCC2

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL4455107 0.88
SCHEMBL4014164 0.68 SHMT2 (0.40)
SCHEMBL2231818 0.68
SCHEMBL5475421 0.68 SHMT2 (0.40)
SCHEMBL30708579 0.68
SCHEMBL556889 0.66 SIGMAR1 (0.43) SIGMAR1
SCHEMBL29460883 0.66 SIGMAR1 (0.43) SIGMAR1
SCHEMBL29438246 0.66
SCHEMBL35277 0.66
SCHEMBL12833371 0.64 SIGMAR1 (0.52) SIGMAR1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596727-B1 Substituted 4-amino- and 4-alkoxy-cycloalkylpyrimidines, processes for their preparation, and their use as pesticides and fungicides control of pests and as fungicides. HOECHST AKTIENGESELLSCHAFT (DE) 2003-07-22 US claimed
JP-2619606-B2 HOECHST AG (DE) 1997-06-11 JP claimed
EP-0631575-A1 SUBSTITUTED PYRIMIDINES AND THEIR USE AS PESTICIDES Hoechst Schering AgrEvo GmbH (DE) 1995-01-04 EP claimed
WO-1993019050-A1 SUBSTITUTED PYRIMIDINES AND THEIR USE AS PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 1993-09-30 WO claimed
EP-1663994-B1 TETRAHYDROQUINAZOLINE COMPOUNDS AS INHIBITORS OF VOLTAGE-GATED ION CHANNELS VERTEX PHARMA (US) 2012-03-07 EP disclosed
US-6596727-B1 Substituted 4-amino- and 4-alkoxy-cycloalkylpyrimidines, processes for their preparation, and their use as pesticides and fungicides control of pests and as fungicides. HOECHST AKTIENGESELLSCHAFT (DE) 2003-07-22 US disclosed
US-5571815-A Substituted pyrimidines, process for their preparation, and their use as pesticides and fungicides HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-05 US disclosed
EP-0631575-A1 SUBSTITUTED PYRIMIDINES AND THEIR USE AS PESTICIDES Hoechst Schering AgrEvo GmbH (DE) 1995-01-04 EP disclosed
WO-1993019050-A1 SUBSTITUTED PYRIMIDINES AND THEIR USE AS PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 1993-09-30 WO disclosed