SCHEMBL3716149

SCHEMBL3716149

C[Si](C)(C)c1ccc(NC(=O)N2CCN(c3ccccc3F)CC2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.75
HTR1A P08908 1/20 0.59
HTR1D P28221 1/20 0.59
HTR1B P28222 1/20 0.59
HTR2C P28335 1/20 0.59
HTR6 P50406 1/20 0.59
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.57
PANK3 Q9H999 1/20 0.57
TRPV1 Q8NER1 3/20 0.55
MAPT P10636 3/20 0.54
TP53 P04637 1/20 0.54
RBP4 P02753 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
TSHR P16473 1/20 0.51
KDM4E B2RXH2 1/20 0.50
ALOX15 P16050 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL3710143 0.86 SMN1; SMN2 (0.65) POLBHTR1AHTR1DHTR1BHTR2C
SCHEMBL29178288 0.86 POLB (0.81) POLBHTR1AHTR1DHTR1BHTR2C
SCHEMBL3716167 0.86 TRPV1 (0.75) KMT2AMEN1TRPV1RBP4
SCHEMBL3713332 0.85 MEN1 (0.59) POLBHTR1AHTR1DHTR1BHTR2C
SCHEMBL3705471 0.82 TRPV1 (0.62) TRPV1
SCHEMBL3781732 0.82 CA12 (0.71) POLBKMT2AMEN1TRPV1MAPT
SCHEMBL3714314 0.81 TRPV1 (0.60) POLBHTR1AHTR1DHTR1BHTR2C
SCHEMBL3709637 0.78 KDM4E (0.78) POLBKMT2AMEN1L3MBTL1PANK3
SCHEMBL3712388 0.78 PDGFRB (0.62) KMT2AMEN1TRPV1MAPTKDM4E
SCHEMBL3709422 0.77 LMNA (0.53) POLBPANK3TRPV1MAPTTP53

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