SCHEMBL4268041

SCHEMBL4268041

CCCOc1cncc(OCCC)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
GABRE P78334 1/20 0.38
GABRA6 Q16445 1/20 0.38
GABRG1 Q8N1C3 1/20 0.38
GABRG3 Q99928 1/20 0.38
GABRQ Q9UN88 1/20 0.38
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.36
PDE2A O00408 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
SCHEMBL4263969 0.88 CYP2D6 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL2491035 0.87 MAPT (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4437979 0.86 CDK2 (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4265088 0.80 AOC3 (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL30339345 0.77 CYP2D6 (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4278696 0.77 CYP2D6 (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL2521218 0.76 HTR7 (0.47) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21044517 0.76 RAB9A (0.49) ALDH1A1HTTMAPTATMHSD17B10
SCHEMBL16631651 0.76 CYP2D6 (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16440211 0.76 NPC1 (0.40) GABRPGABRDGABRA1GABRB1GABRG2

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