SCHEMBL14023316

SCHEMBL14023316

C=C(COC)N1CCC(C(C)=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ MAPT P10636 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35

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
SCHEMBL12436958 0.84 POLB (0.44) SMN1; SMN2L3MBTL1ALDH1A1MAPTPOLB
SCHEMBL14023298 0.77 MAPT (0.53) GAASMN1; SMN2ALDH1A1MAPTPOLB
SCHEMBL13806334 0.77 GAA (0.36) GAASMN1; SMN2MAPTPOLBKMT2A
SCHEMBL19999715 0.75 KDM5A (0.33) GAAALDH1A1MAPTPOLB
SCHEMBL12436979 0.74 ALDH1A1 (0.47) ALDH1A1POLBTSHRKMT2AMEN1
SCHEMBL12436920 0.73 GAA (0.46) GAASMN1; SMN2ALDH1A1MAPTPOLB
SCHEMBL190928 0.72 CYP1A2 (0.48) SMN1; SMN2
SCHEMBL22051142 0.71 ALDH1A1 (0.44) GAASMN1; SMN2L3MBTL1ALDH1A1HTT
SCHEMBL23541545 0.70 SMN1; SMN2 (0.49) GAASMN1; SMN2ALDH1A1MAPTPOLB
SCHEMBL12436957 0.70 GAA (0.71) GAASMN1; SMN2L3MBTL1ALDH1A1MAPT

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
WO-2008133344-A2 PIPERIDINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 — — WO disclosed
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