SCHEMBL27564353

SCHEMBL27564353

O=C(O)C1CCCN(CC2CCCC2)C1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM2B Q8NHM5 14/20 0.52
▸ KDM4E B2RXH2 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ CHRM5 P08912 1/20 0.48
▸ ADRA2C P18825 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48

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
SCHEMBL27584327 0.98 CHRM5 (0.52) KDM2BKDM4EMAPK1CHRM5ADRA2C
SCHEMBL27584353 0.96 KDM2B (0.52) KDM2BALDH1A1
SCHEMBL21047314 0.95 KDM2B (0.57) KDM2B
SCHEMBL13905846 0.85 SMN1; SMN2 (0.47) KDM2BKDM4EMAPK1CHRM5ADRA2C
SCHEMBL13905729 0.83 SMN1; SMN2 (0.50) KDM2BKDM4EMAPK1CHRM5ADRA2C
SCHEMBL17873962 0.81 SMN1; SMN2 (0.43) KDM2BCHRM5ADRA2C
SCHEMBL28941581 0.79 CHRM5 (0.48) KDM2BKDM4EMAPK1CHRM5ADRA2C
SCHEMBL740141 0.78 SMN1; SMN2 (0.54) KDM2BALDH1A1
SCHEMBL771607 0.78 SMN1; SMN2 (0.54) KDM2BALDH1A1
SCHEMBL1609328 0.78 SMN1; SMN2 (0.54) KDM2BALDH1A1

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
CN-1374959-A Piperidine quinolyl propyl derivatives, preparation method and compositions containing same AVENTIS PHARMA SA (FR) 2002-10-16 — — CN disclosed
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