SCHEMBL6590305

SCHEMBL6590305

CC(C)(C)OC(=O)NC1CCN(C(C(=O)Oc2ccccc2)C2CCNCC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.46
CKS1B P61024 2/20 0.46
SKP1 P63208 2/20 0.46
SKP2 Q13309 2/20 0.46
KDM1A O60341 1/20 0.42
MAOB P27338 1/20 0.42
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DRD2 P14416 2/20 0.41
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
NAMPT P43490 1/20 0.40
CCR5 P51681 1/20 0.40
PARP1 P09874 1/20 0.40
EPHX2 P34913 1/20 0.40
CTSK P43235 2/20 0.39
KDM5A P29375 1/20 0.39
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38

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
SCHEMBL6580060 0.87 KCNA3 (0.47) KCNA3CKS1BSKP1SKP2KDM1A
SCHEMBL6586301 0.84 CTSK (0.41) KCNA3CKS1BSKP1SKP2NAMPT
SCHEMBL6584900 0.80 CTSK (0.46) KCNA3CKS1BSKP1SKP2DRD2
SCHEMBL6588968 0.79 CTSK (0.45) KCNA3CKS1BSKP1SKP2DRD2
SCHEMBL6586597 0.78 CTSK (0.44) KCNA3CKS1BSKP1SKP2DRD2
SCHEMBL6586538 0.76 CTSK (0.43) KCNA3CKS1BSKP1SKP2ALDH1A1
SCHEMBL6586675 0.75 CTSK (0.41) KCNA3DRD2PARP1CTSKKDM5A
SCHEMBL1412244 0.74 ALDH1A1 (0.66) KCNA3CKS1BSKP1SKP2KDM1A
SCHEMBL6585699 0.74 HTR4 (0.62) DRD2
SCHEMBL6585663 0.73 CTSK (0.40) KCNA3PARP1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1076055-B1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS DAINIPPON PHARMACEUTICAL CO (JP) 2004-11-24 EP disclosed
US-6294555-B1 SEROTONIN HT3 RECEPTOR ANTAGONIST FOR GASTROINTESTINAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2001-09-25 US disclosed
EP-1076055-A1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS Dainippon Pharmaceutical Co., Ltd. (JP) 2001-02-14 EP disclosed