SCHEMBL27653271

SCHEMBL27653271

ON1NNc2cc(Cl)ccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.33
AADAT Q8N5Z0 1/20 0.33
CES1 P23141 1/20 0.32
HTT P42858 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CA12 O43570 3/20 0.32
CA9 Q16790 3/20 0.32
MYC P01106 1/20 0.32
NR4A1 P22736 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 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
SCHEMBL27653174 0.84 PTPN1 (0.35) DAOAADATCES1GAACA12
SCHEMBL27673113 0.76 DAO (0.33) DAOAADATHTTKDM4ELMNA
SCHEMBL27681806 0.63 HSD17B10 (0.37) DAOAADATHTTKDM4ELMNA
SCHEMBL10432082 0.62 PTPN1 (0.33) DAOAADATCES1CA12CA9
SCHEMBL22431926 0.60 CHEK1 (0.41) CES1LMNAALOX15SMN1; SMN2CMA1
SCHEMBL24731338 0.59 KMT2A (0.36) HTTKDM4ELMNAALOX12CMA1
SCHEMBL13868943 0.58 CHEK1 (0.59) CES1CA12CA9CA2CA4
SCHEMBL13868946 0.58 CHEK1 (0.59) CES1CA12CA9CA2CA4
Fluoride SCHEMBL3292595 0.57
SCHEMBL11647371 0.55 HSP90AA1 (0.54) HTTLMNACYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100528937-C Method for producing carbonyl rest-containing organosilicon compounds WACKER CHEMIE GMBH (DE) 2009-08-19 CN disclosed
CN-1906230-A Method for producing carbonyl group-containing organosilicon compound WACKER CHEMIE GMBH (DE) 2007-01-31 CN disclosed