SCHEMBL13629954

SCHEMBL13629954

CCC(=O)CN1CCC(C(C)=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
TERT O14746 1/20 0.36
ALDH1A1 P00352 7/20 0.35
KDM4E B2RXH2 3/20 0.35
PKM P14618 1/20 0.35
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
KMT2A Q03164 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL20821228 0.84 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1KDM4EPKMMAPT
SCHEMBL6219127 0.83 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1KDM4EPKMGAA
SCHEMBL13629917 0.82 SMN1; SMN2 (0.44) SMN1; SMN2TERTALDH1A1KDM4EPKM
SCHEMBL28164677 0.82 SMN1; SMN2 (0.44) SMN1; SMN2TERTALDH1A1KDM4EPKM
SCHEMBL14268127 0.80 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL21983188 0.80 ALDH1A1 (0.40) SMN1; SMN2TERTALDH1A1KDM4EMAPT
SCHEMBL14621507 0.80 HSD17B10 (0.45) SMN1; SMN2TERTALDH1A1KDM4EGAA
SCHEMBL12156678 0.79 SMN1; SMN2 (0.67) SMN1; SMN2KMT2A
SCHEMBL16076280 0.79 TDP1 (0.47) SMN1; SMN2ALDH1A1KDM4EMAPTGAA
SCHEMBL19268642 0.79 TDP1 (0.47) SMN1; SMN2ALDH1A1KDM4EMAPTGAA

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-7622487-B2 Piperidine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-24 US disclosed
US-7622487-B2 Piperidine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-24 US disclosed