SCHEMBL9116314

SCHEMBL9116314

CCc1ccc(C(=S)c2cnoc2C2CC2)c(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.40
HSP90AA1 P07900 1/20 0.33
POLB P06746 1/20 0.31
NAMPT P43490 1/20 0.31

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
SCHEMBL9115219 0.84 DHODH (0.42) DHODH
SCHEMBL9116360 0.77 DHODH (0.42) DHODHPOLB
SCHEMBL9115891 0.75 DHODH (0.37) DHODH
SCHEMBL9114542 0.75 DHODH (0.39) DHODH
SCHEMBL7576057 0.74 PTPN1 (0.34) DHODHNAMPT
SCHEMBL9238887 0.74 DHODH (0.43) DHODH
SCHEMBL9115692 0.73 DHODH (0.39) DHODH
SCHEMBL7575665 0.73 NAMPT (0.35) DHODHNAMPT
SCHEMBL9116943 0.73 DHODH (0.37) DHODH
SCHEMBL9115943 0.72 DHODH (0.40) DHODH

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-1995022903-A1 NEW PESTICIDAL METHOD RHONE-POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed