SCHEMBL27619692

SCHEMBL27619692

CC1(C)COCCN1CCC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GRM2 Q14416 1/20 0.37
GLA P06280 1/20 0.33
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 2/20 0.31
GRM5 P41594 2/20 0.31

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
SCHEMBL2744458 0.77 GRM2 (0.31) GRM2
SCHEMBL2744441 0.77 KDM4E (0.41) KDM4EGRM2
SCHEMBL3176003 0.77 KEAP1 (0.36) GRM2SMN1; SMN2
SCHEMBL17524640 0.76 GRM2 (0.32) KDM4EGRM2
SCHEMBL4550236 0.74 KDM4E (0.30) KDM4E
SCHEMBL6835435 0.74 KEAP1 (0.47) GRM2SMN1; SMN2
SCHEMBL9801574 0.74 KDM4E (0.34) KDM4EGRM2
SCHEMBL3366427 0.74 HSD17B10 (0.46) KDM4EGRM2GLAJAK2JAK1
SCHEMBL14167508 0.73 PAOX (0.37) KDM4EGLASMN1; SMN2GAA
SCHEMBL23254096 0.73

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
CN-1774435-A 5-membered heterocyclic derivative DAIICHI SEIYAKU CO (JP) 2006-05-17 CN disclosed
CN-1759110-A Pyrazole derivatives DAIICHI SEIYAKU CO (JP) 2006-04-12 CN disclosed