SCHEMBL4552239

SCHEMBL4552239

C=CC(NCc1ccccc1)NC(CC)[Si](OC)(OC)OC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
ATM Q13315 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TSHR P16473 1/20 0.34
CASR P41180 1/20 0.34
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
POLB P06746 1/20 0.32
TACR1 P25103 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CDK1 P06493 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL1116631 0.81 SIGMAR1 (0.44) SIGMAR1L3MBTL1CASRMEN1KMT2A
SCHEMBL144037 0.81 SIGMAR1 (0.42) SMN1; SMN2SIGMAR1ATML3MBTL1CASR
Hydrochloric Acid SCHEMBL8927852 0.80 SIGMAR1 (0.41) SMN1; SMN2SIGMAR1ATML3MBTL1CASR
SCHEMBL26104988 0.75 LMNA (0.33) SMN1; SMN2TSHRMEN1KMT2AGAA
SCHEMBL145174 0.71 MMP8 (0.31) MEN1KMT2A
Hydrochloric Acid SCHEMBL28376502 0.70 HTT (0.31)
SCHEMBL7783746 0.69 MTOR (0.34) SMN1; SMN2TSHRPOLB
SCHEMBL9860450 0.69 SMN1; SMN2 (0.38) SMN1; SMN2SIGMAR1ATML3MBTL1TSHR
SCHEMBL11053872 0.69 GAA (0.33) SIGMAR1ATMTSHRNPSR1GAA
SCHEMBL28530223 0.69 SIGMAR1 (0.45) SMN1; SMN2SIGMAR1ATML3MBTL1CASR

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-1729892-B1 METHOD FOR COATING A SUBSTRATE USING DIELECTRIC BARRIER DISCHARGE VITO (BE) 2009-06-17 EP claimed