SCHEMBL7845992

SCHEMBL7845992

C[Si](C)(C)c1cccc(Cl)c1C(=O)NC1CCC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.52
TAS1R3 Q7RTX0 3/20 0.51
TAS1R1 Q7RTX1 3/20 0.51
TAS1R2 Q8TE23 3/20 0.51
KMT2A Q03164 5/20 0.51
P2RX7 Q99572 1/20 0.48
RAB9A P51151 6/20 0.46
NPC1 O15118 5/20 0.46
MEN1 O00255 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.44
GHSR Q92847 1/20 0.44
TSHR P16473 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GRM5 P41594 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL7856701 0.96 KMT2A (0.56) MAPK14TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL7853944 0.94 P2RX7 (0.54) MAPK14TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL6428937 0.77 DOT1L (0.50) TAS1R3TAS1R1TAS1R2RAB9AL3MBTL1
SCHEMBL7218191 0.77 P2RX7 (0.40) MAPK14TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL7855526 0.77 CHRM1 (0.49) P2RX7POLBTSHR
SCHEMBL7852285 0.77 TSHR (0.43) TAS1R3TAS1R1TAS1R2KMT2AP2RX7
SCHEMBL7846596 0.75 HPGD (0.45) P2RX7RAB9ANPC1POLBTSHR
SCHEMBL9017627 0.75 MAPK14 (0.55) MAPK14TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL9884064 0.75 P2RX7 (0.58) MAPK14TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL7845245 0.74 POLB (0.46) KMT2AP2RX7RAB9ANPC1L3MBTL1

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
EP-1088481-A2 Fungicides for the control of take-all disease of plants MONSANTO COMPANY (US) 2001-04-04 EP disclosed