SCHEMBL7463261

SCHEMBL7463261

CCOC(=O)c1ccc(N2CCCCC2N)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.42
MAPT P10636 3/20 0.41
MAPK1 P28482 2/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 7/20 0.41
BAZ2B Q9UIF8 1/20 0.41
BAZ2A Q9UIF9 1/20 0.41
KDM4E B2RXH2 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
RAB9A P51151 2/20 0.39
CACNA1F O60840 2/20 0.39
CACNA1D Q01668 2/20 0.39
CACNA1S Q13698 2/20 0.39
CACNA1C Q13936 2/20 0.39
TSHR P16473 2/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL7467830 0.88 MAPT (0.44) CASP3MAPTMAPK1HTTALDH1A1
SCHEMBL7052909 0.87 RAB9A (0.43) MAPTHTTALDH1A1KDM4EKMT2A
SCHEMBL7468705 0.84 KDM4E (0.41) MAPTMAPK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7051580 0.81 HPGD (0.50) MAPTMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL7470661 0.79 OPRK1 (0.42) CASP3MAPTMAPK1HTTALDH1A1
SCHEMBL7463266 0.79 PRKD3 (0.47) MAPTMAPK1HTTALDH1A1BAZ2B
SCHEMBL382515 0.77 HTT (0.51) MAPTMAPK1HTTALDH1A1KDM4E
SCHEMBL28044539 0.76 MYC (0.42) MAPTALDH1A1KDM4ESMN1; SMN2KMT2A
SCHEMBL17825662 0.70 KMT2A (0.58) MAPK1ALDH1A1BAZ2BBAZ2AKMT2A
SCHEMBL17261711 0.70 CYP4F2 (0.47) MAPK1ALDH1A1BAZ2BBAZ2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1227083-A1 3-AMINOPIPERIDINE DERIVATIVES AS INTEGRIN $g(a)v$g(b)3 ANTAGONISTS MEIJI SEIKA KAISHA LTD. (JP) 2002-07-31 EP disclosed