SCHEMBL19403245

SCHEMBL19403245

CC(C)(C)[S@+]([O-])/N=C/c1cc[nH]n1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.32

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
SCHEMBL19403247 1.00 GPR3 (0.32) GPR3
SCHEMBL6901526 0.73
SCHEMBL17239489 0.73
SCHEMBL16043725 0.70
SCHEMBL22230368 0.70 NR4A1 (0.47) GPR3
SCHEMBL16043727 0.70
SCHEMBL16043729 0.70
SCHEMBL22230365 0.70 NR4A1 (0.47) GPR3
SCHEMBL14737431 0.70 GPR3 (0.32) GPR3
SCHEMBL12315085 0.70 NR4A1 (0.47) GPR3

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-2017162611-A1 QUINOLINE-3-CARBOXAMIDE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-09-28 WO disclosed