SCHEMBL7478239

SCHEMBL7478239

CC(C)(C)[C@H]1OC(=O)[C@](c2ccccc2)(C2CCC(=O)CC2)O1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
CYP2C9 P11712 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 4/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHRM2 P08172 2/20 0.32
CHRM4 P08173 2/20 0.32
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL4524592 0.92 MAPK1 (0.33) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL8309292 0.92 MAPK1 (0.33) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL4516595 0.92 MAPK1 (0.33) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL5792460 0.92 MAPK1 (0.33) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL8308908 0.92 MAPK1 (0.33) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL13715499 0.89 L3MBTL1 (0.43) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL2062804 0.89 L3MBTL1 (0.43) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL19839514 0.89 L3MBTL1 (0.43) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL19839538 0.89 L3MBTL1 (0.43) MAPK1SMN1; SMN2L3MBTL1TDP1CHRM2
SCHEMBL7681801 0.88 L3MBTL1 (0.44) L3MBTL1TDP1CHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930298-B1 FLUORINATED 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-12-18 EP disclosed
EP-1061076-A1 N-ACYL CYCLIC AMINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-12-20 EP disclosed
US-6140333-A FOR TREATMENT AND/OR PROPHYLAXIS OF DISEASES INCLUDE SUCH RESPIRATORY DISEASES AS CHRONIC OBSTRUCTIVE PULMONARY DISEASES, CHRONIC BRONCHITIS, ASTHMA, CHRONIC RESPIRATORY OBSTRUCTION, PULMONARY FIBROSIS, PULMONARY EMPHYSEMA BANYU PHARMACEUTICAL CO LTD (JP) 2000-10-31 US disclosed
US-6040449-A USEFUL FOR FORMING FLUORINE CONTAINING 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES, USEFUL AS ANTAGONIST FOR MUSCARINIC M3 RECEPTORS AND LESS SIDE EFFECT BANYU PHARMACEUTICAL CO LTD (JP) 2000-03-21 US disclosed
US-5948792-A POTENT AND SELECTIVE ANTAGONISTS FOR MUSCARINIC M.SUB.3 RECEPTORS WITH LITTLE SIDE EFFECTS. BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-07 US disclosed
EP-0930298-A1 FLUORINATED 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-21 EP disclosed