SCHEMBL212168

SCHEMBL212168

CC(=NO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)c1cccn1C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PKM P14618 1/20 0.37
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 2/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 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
SCHEMBL212035 0.84 HSD17B10 (0.38) RAB9ANPC1NFKB1NFKB2RELA
SCHEMBL212055 0.78 NPC1 (0.41) RAB9ANPC1NFKB1NFKB2RELA
SCHEMBL17256870 0.75 SMN1; SMN2 (0.30) RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL212909 0.75 HSD17B10 (0.40) RAB9ANPC1NFKB1NFKB2RELA
SCHEMBL211644 0.75 LMNA (0.53) RAB9ANPC1SMN1; SMN2PKMALDH1A1
SCHEMBL2048180 0.73 LMNA (0.35) SMN1; SMN2MAPT
SCHEMBL213426 0.73 SMN1; SMN2 (0.38) SMN1; SMN2HSD17B10MAPTTSHRCYP2C9
SCHEMBL2048184 0.73 LMNA (0.35) SMN1; SMN2MAPT
SCHEMBL17256883 0.72 ALDH1A1 (0.34) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL17257397 0.72 ALDH1A1 (0.34) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088868-B2 oximation of cojugated homopolymers formed by addtion polymerization of conjugated diene monomer in the presence lanthanide copmpounds as polymerization catalysts; polymers used in the manufacture of tires having reduced hysteresis BRIDGESTONE CORPORATION (JP) 2012-01-03 US claimed
US-20080146745-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2008-06-19 US claimed
US-8088868-B2 oximation of cojugated homopolymers formed by addtion polymerization of conjugated diene monomer in the presence lanthanide copmpounds as polymerization catalysts; polymers used in the manufacture of tires having reduced hysteresis BRIDGESTONE CORPORATION (JP) 2012-01-03 US disclosed
US-20080146745-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2008-06-19 US disclosed