SCHEMBL5022923

SCHEMBL5022923

CC(=O)N1CCCC(F)CC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.47
EPHX1 P07099 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
CYP1A2 P05177 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
QDPR P09417 1/20 0.39

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
SCHEMBL4550276 0.91 SMN1; SMN2 (0.52) EPHX2EPHX1SMN1; SMN2CYP1A2TDP1
SCHEMBL21938965 0.85 DPP4 (0.42) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL2760455 0.85 DPP4 (0.42) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL25010712 0.85 DPP4 (0.42) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL14275857 0.81 EPHX2 (0.46) EPHX2EPHX1SMN1; SMN2CYP1A2TDP1
SCHEMBL524352 0.80 EPHX2 (0.48) EPHX2EPHX1SMN1; SMN2CYP1A2TDP1
SCHEMBL5017003 0.79 DPP4 (0.45) EPHX2EPHX1SIGMAR1
SCHEMBL22142236 0.78 ALDH1A1 (0.48) EPHX2EPHX1SMN1; SMN2CYP1A2TDP1
SCHEMBL13438123 0.78 ALDH1A1 (0.48) EPHX2EPHX1SMN1; SMN2CYP1A2TDP1
SCHEMBL22142324 0.78 ALDH1A1 (0.48) EPHX2EPHX1SMN1; SMN2CYP1A2TDP1

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-20080070123-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY SANYO ELECTRIC CO., LTD. (JP) 2008-03-20 US disclosed
US-20060035155-A1 Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery SANYO ELECTRIC CO., LTD. (JP) 2006-02-16 US disclosed