SCHEMBL213953

SCHEMBL213953

c1ccc(C(=NO[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 4/20 0.37
POLB P06746 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36
TBXA2R P21731 6/20 0.36
TBXAS1 P24557 4/20 0.36
MAPK1 P28482 2/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL17257004 0.85 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL2052781 0.83 CYP2C19 (0.35) ALDH1A1SMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL2052783 0.83 CYP2C19 (0.35) ALDH1A1SMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL17257428 0.82 GSK3B (0.39) ALDH1A1SMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL212674 0.81 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL211644 0.80 LMNA (0.53) ALDH1A1SMN1; SMN2CYP1A2CYP2D6HPGD
SCHEMBL215575 0.79 HSD11B1 (0.41) ALDH1A1SMN1; SMN2HPGDKMT2APOLB
SCHEMBL2050836 0.79 PPARA (0.40) MAPK1MAPTLMNAHTTL3MBTL1
SCHEMBL2050834 0.79 PPARA (0.40) MAPK1MAPTLMNAHTTL3MBTL1
SCHEMBL2048184 0.77 LMNA (0.35) SMN1; SMN2MAPK1MAPTLMNAHTT

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