SCHEMBL2548183

SCHEMBL2548183

CCCCc1ccccc1/N=C(\C)c1cccc(/C(C)=N/c2c(C)cccc2C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
TLR8 Q9NR97 1/20 0.32
KCNH2 Q12809 1/20 0.31
ALPL P05186 1/20 0.31
ALPG P10696 1/20 0.31
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
CYSLTR2 Q9NS75 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
SCHEMBL2548184 1.00 CYP3A4 (0.41) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL2548838 0.98 CYP3A4 (0.40) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL2548833 0.98 CYP3A4 (0.40) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA
SCHEMBL18543925 0.91 CYP3A4 (0.48) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA
SCHEMBL21113622 0.85 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA
SCHEMBL18543904 0.83 CYP3A4 (0.37) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA
SCHEMBL12266826 0.81 SIGMAR1 (0.41) CYP2C9GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2552264 0.81 SIGMAR1 (0.41) CYP2C9GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2552266 0.81 SIGMAR1 (0.41) CYP2C9GRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7184074 0.80 KCNH2 (0.37) CYP3A4CYP2D6CYP2C9SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9175104-B2 Ethylene polymerization process and polyolefin E I DU PONT DE NEMOURS AND COMPANY (US) 2015-11-03 US disclosed
US-9175104-B2 Ethylene polymerization process and polyolefin E I DU PONT DE NEMOURS AND COMPANY (US) 2015-11-03 US disclosed
US-9175104-B2 Ethylene polymerization process and polyolefin E I DU PONT DE NEMOURS AND COMPANY (US) 2015-11-03 US disclosed
US-8916664-B2 Olefin polymerization process E I DU PONT DE NEMOURS AND COMPANY (US) 2014-12-23 US disclosed
US-8916664-B2 Olefin polymerization process E I DU PONT DE NEMOURS AND COMPANY (US) 2014-12-23 US disclosed
US-8916664-B2 Olefin polymerization process E I DU PONT DE NEMOURS AND COMPANY (US) 2014-12-23 US disclosed
EP-2552973-A1 IMPROVED OLEFIN POLYMERIZATION PROCESS E.I. Du Pont De Nemours And Company (US) 2013-02-06 EP disclosed
EP-2552972-A1 IMPROVED ETHYLENE POLYMERIZATION PROCESS AND POLYOLEFIN E.I. Du Pont De Nemours And Company (US) 2013-02-06 EP disclosed
US-20120309915-A1 ETHYLENE POLYMERIZATION PROCESS AND POLYOLEFIN E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-06 US disclosed
US-20120309915-A1 ETHYLENE POLYMERIZATION PROCESS AND POLYOLEFIN E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-06 US disclosed
US-20120309916-A1 OLEFIN POLYMERIZATION PROCESS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-06 US disclosed
US-20120309916-A1 OLEFIN POLYMERIZATION PROCESS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-06 US disclosed
US-20120309915-A1 ETHYLENE POLYMERIZATION PROCESS AND POLYOLEFIN E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-06 US disclosed
US-20120309916-A1 OLEFIN POLYMERIZATION PROCESS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-06 US disclosed
WO-2011126787-A1 IMPROVED OLEFIN POLYMERIZATION PROCESS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-13 WO disclosed
WO-2011126784-A1 IMPROVED ETHYLENE POLYMERIZATION PROCESS AND POLYOLEFIN E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-13 WO disclosed
WO-2011126787-A1 IMPROVED OLEFIN POLYMERIZATION PROCESS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-13 WO disclosed
WO-2011126784-A1 IMPROVED ETHYLENE POLYMERIZATION PROCESS AND POLYOLEFIN E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-13 WO disclosed