SCHEMBL4276004

SCHEMBL4276004

CC(C)Oc1cc(OC(C)C)nc(OC(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.39
MCL1 Q07820 2/20 0.38
BTK Q06187 1/20 0.38
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
PDE4A P27815 1/20 0.36

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
SCHEMBL8370932 0.78 ALDH1A1 (0.44) KMT2APOLBSMN1; SMN2ALDH1A1GRIN2D
SCHEMBL15984884 0.75 MAPK1 (0.44) KMT2AMEN1CYP1A2POLBCYP2D6
SCHEMBL4270430 0.75 MAPT (0.39) KMT2AMEN1CYP1A2POLBCYP2D6
SCHEMBL19088240 0.73 SYK (0.36) KMT2AALDH1A1MCL1GRIN2DGRIN3B
SCHEMBL31326815 0.73 NOS3 (0.43) KMT2ACYP2D6CYP2C19ALDH1A1MCL1
SCHEMBL6828247 0.73 NUDT1 (0.44) KMT2AMEN1CYP1A2POLBCYP2D6
SCHEMBL6826174 0.73 MAPT (0.45) KMT2AMEN1CYP1A2POLBCYP2D6
SCHEMBL31543490 0.73 ALDH1A1 (0.35) KMT2AALDH1A1MCL1GRIN2DGRIN3B
SCHEMBL22576042 0.73 MAPT (0.38) KMT2AMEN1CYP1A2POLBCYP2D6
SCHEMBL2656280 0.73 KMT2A (0.52) KMT2AALDH1A1MAPTMCL1RXRA

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
US-7605215-B2 Process for producing olefin copolymerization catalyst and process for producing olefin copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-20 US disclosed
US-20080227937-A1 Process for Producing Olefin Copolymerization Catalyst and Process for Producing Olefin Copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-18 US disclosed