SCHEMBL5596124

SCHEMBL5596124

OCP(CO)[SiH2]C(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
TRPA1 O75762 5/20 0.35
HTR2A P28223 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP2D6 P10635 1/20 0.33
SRC P12931 1/20 0.33
AOC3 Q16853 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HRH1 P35367 1/20 0.32
MTOR P42345 1/20 0.32
RAB9A P51151 1/20 0.32
GRM7 Q14831 1/20 0.32
MAPK1 P28482 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
SCHEMBL5595943 0.83 TRPA1 (0.35) LMNATRPA1HTR2ATAAR1KDM4E
SCHEMBL5596219 0.80 ALDH1A1 (0.37) LMNATRPA1HTR2ATAAR1KDM4E
SCHEMBL20568160 0.74 DPP4 (0.39) LMNAHTR2ATAAR1CYP2D6SRC
SCHEMBL5596580 0.74 TRPA1 (0.34) LMNATRPA1HTR2ATAAR1KDM4E
SCHEMBL5595935 0.71 TRPA1 (0.33) LMNATRPA1
SCHEMBL7935090 0.70 LMNA (0.39) LMNATRPA1HTR2ATAAR1KDM4E
SCHEMBL5596091 0.68 LMNA (0.42) LMNAHTR2ATAAR1KDM4ECYP2D6
SCHEMBL5596479 0.67 ALDH1A1 (0.35) LMNAKDM4EL3MBTL1CYP2D6SRC
SCHEMBL5613303 0.67 DPP4 (0.33) LMNAHTR2ATAAR1KDM4ECYP2D6
SCHEMBL3454935 0.67 TRPA1 (0.38) LMNATRPA1HTR2ATAAR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed