SCHEMBL7066946

SCHEMBL7066946

C=CCC(COC)(COC)c1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AHR P35869 2/20 0.35
CHRM2 P08172 1/20 0.35
KDM4E B2RXH2 2/20 0.32
RAB9A P51151 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PTBP1 P26599 1/20 0.32
OPRK1 P41145 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C19 P33261 1/20 0.31
BLM P54132 1/20 0.30
CYP2D6 P10635 1/20 0.30
NFE2L2 Q16236 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
SCHEMBL28655249 0.76 L3MBTL1 (0.45) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL21742046 0.76 SMN1; SMN2 (0.39) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL3299722 0.75 SMN1; SMN2 (0.44) SMN1; SMN2L3MBTL1CHRM2KDM4ERAB9A
SCHEMBL21742327 0.74 SMN1; SMN2 (0.37) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL21742378 0.73 AHR (0.39) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL21742319 0.72 CHRM2 (0.43) SMN1; SMN2L3MBTL1CHRM2KDM4ERAB9A
SCHEMBL4789499 0.72 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL21742149 0.72 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL21742315 0.72 SMN1; SMN2 (0.38) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E
SCHEMBL21742047 0.71 SMN1; SMN2 (0.37) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891988-B1 Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE SPA (IT) 2003-06-04 EP disclosed
EP-0451645-B1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC (US) 1999-05-12 EP disclosed
EP-0891988-A2 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1999-01-20 EP disclosed
US-5068213-A COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS HINMONT INCORPORATED (US) 1991-11-26 US disclosed
EP-0451645-A2 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1991-10-16 EP disclosed