SCHEMBL18551663

SCHEMBL18551663

CCc1cccc(N(C)c2nc(C)nc(N)c2Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 20/20 0.40

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
SCHEMBL22704314 0.81 MEN1 (0.48)
SCHEMBL18540817 0.80 KDR (0.42)
SCHEMBL17485887 0.72 SIGMAR1 (0.51) SIGMAR1
SCHEMBL19033038 0.70 KDR (0.56)
SCHEMBL18540823 0.70 KDR (0.56)
SCHEMBL22699501 0.68 ADORA1 (0.34)
SCHEMBL17374722 0.67 SIGMAR1 (0.54) SIGMAR1
SCHEMBL25922215 0.67 SIGMAR1 (0.50) SIGMAR1
SCHEMBL10130332 0.65 SIGMAR1 (0.53) SIGMAR1
SCHEMBL129446 0.65 SIGMAR1 (0.51) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017031176-A1 MONOCYCLIC, THIENO, PYRIDO, AND PYRROLO PYRIMIDINE COMPOUNDS AND METHODS OF USE AND MANUFACTURE OF THE SAME DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2017-02-23 WO disclosed