SCHEMBL9624898

SCHEMBL9624898

CCOC(=O)N1CCC=C(C=O)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
POLB P06746 2/20 0.44
ABL1 P00519 1/20 0.44
RIN1 Q13671 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TSHR P16473 2/20 0.44
GAA P10253 3/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 6/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
RAB9A P51151 2/20 0.43
MAPK1 P28482 1/20 0.43
MDM2 Q00987 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL9625460 0.90 SMN1; SMN2 (0.39) MAPTPOLBABL1RIN1TDP1
SCHEMBL9627031 0.87 SMN1; SMN2 (0.50) POLBTDP1KDM4ELMNAALDH1A1
SCHEMBL9625448 0.84 L3MBTL1 (0.40) MAPTTSHRLMNAALDH1A1KMT2A
SCHEMBL9625561 0.84 ERN1 (0.43) LMNARAB9AMAPK1NPSR1
SCHEMBL9456810 0.84 MAPT (0.40) MAPTPOLBABL1RIN1TDP1
SCHEMBL9456814 0.84 MAPT (0.40) MAPTPOLBABL1RIN1TDP1
SCHEMBL9626334 0.83 POLB (0.34) MAPTPOLBABL1RIN1TDP1
SCHEMBL12320612 0.82 MAPT (0.42) MAPTPOLBABL1RIN1TDP1
SCHEMBL9625616 0.82 SMN1; SMN2 (0.33) MAPTPOLBTSHRGAALMNA
SCHEMBL9625440 0.80 MEN1 (0.56) MAPTGAAALDH1A1KMT2AMEN1

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-1436298-B1 HIMBACINE ANALOGUES AS THROMBIN RECEPTOR ANTAGONISTS SCHERING CORP (US) 2011-09-21 EP disclosed
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