SCHEMBL9625460

SCHEMBL9625460

CCCOC(=O)N1CCC=C(C=O)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 3/20 0.39
POLB P06746 2/20 0.39
SMYD3 Q9H7B4 2/20 0.37
PDE4B Q07343 1/20 0.35
CNR2 P34972 1/20 0.35
MAPT P10636 6/20 0.35
ABL1 P00519 1/20 0.35
RIN1 Q13671 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
ALDH1A1 P00352 5/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RAB9A P51151 2/20 0.35
MAPK1 P28482 1/20 0.35
MDM2 Q00987 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
OPRD1 P41143 1/20 0.34

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
SCHEMBL9627031 0.92 SMN1; SMN2 (0.50) SMN1; SMN2LMNAPOLBSMYD3TDP1
SCHEMBL9624898 0.90 MAPT (0.44) SMN1; SMN2LMNAPOLBMAPTABL1
SCHEMBL9457072 0.85 CHRM2 (0.38) SMN1; SMN2LMNAPOLBSMYD3PDE4B
SCHEMBL9626334 0.85 POLB (0.34) SMN1; SMN2LMNAPOLBMAPTABL1
SCHEMBL9457078 0.85 CHRM2 (0.38) SMN1; SMN2LMNAPOLBSMYD3PDE4B
SCHEMBL9625616 0.84 SMN1; SMN2 (0.33) SMN1; SMN2LMNAPOLBMAPTGAA
SCHEMBL9625448 0.80 L3MBTL1 (0.40) SMN1; SMN2LMNAMAPTALDH1A1MEN1
SCHEMBL9626076 0.80 OPRM1 (0.47) SMN1; SMN2POLBALDH1A1MEN1KMT2A
SCHEMBL9625561 0.80 ERN1 (0.43) LMNARAB9AMAPK1NPSR1
SCHEMBL9457164 0.78 SMN1; SMN2 (0.44) SMN1; SMN2LMNAPOLBTDP1KDM4E

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
EP-0308283-B1 1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXALDEHYDE OXIME DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AS PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1992-01-22 EP disclosed
EP-0308283-A1 1,2,5,6-Tetrahydropyridine-3-carboxaldehyde oxime derivatives, process for their preparation, their use as pharmaceutical compounds and compositions containing them ROUSSEL-UCLAF (FR) 1989-03-22 EP disclosed