SCHEMBL3714943

SCHEMBL3714943

C[Si](C)(C)c1ccc(NC(=O)N2CCN(c3cccc4cnccc34)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.61
PHGDH O43175 1/20 0.51
P2RX7 Q99572 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GOT1 P17174 7/20 0.47
PDGFRB P09619 2/20 0.46
POLB P06746 1/20 0.45
RBP4 P02753 1/20 0.44

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
SCHEMBL3712388 0.80 PDGFRB (0.62) TRPV1P2RX7MEN1KMT2APDGFRB
SCHEMBL17737440 0.78 P2RX7 (0.56) TRPV1PHGDHP2RX7MEN1KMT2A
SCHEMBL3710143 0.78 SMN1; SMN2 (0.65) TRPV1MEN1KMT2APOLBRBP4
SCHEMBL3785601 0.77 TRPV1 (0.72) TRPV1POLB
SCHEMBL4021355 0.77 TRPV1 (0.69) TRPV1PHGDHP2RX7KMT2APOLB
SCHEMBL3714314 0.77 TRPV1 (0.60) TRPV1MEN1KMT2AGOT1POLB
SCHEMBL3716149 0.77 POLB (0.75) TRPV1MEN1KMT2APOLBRBP4
SCHEMBL3713332 0.77 MEN1 (0.59) TRPV1MEN1KMT2AGOT1POLB
SCHEMBL3710250 0.76 NAMPT (0.61) TRPV1
SCHEMBL4023952 0.75 TRPV1 (0.69) TRPV1KMT2APOLB

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-2010092342-A1 ORGANOSILICON COMPOUNDS AND THEIR USE AS THE MODULATORS OF THE TRPV1 RECEPTOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-19 WO disclosed