SCHEMBL7471671

SCHEMBL7471671

CC(C)(C)[C@H]1OC(=O)[C@](c2ccccc2)(C2CC(=O)C2)O1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CHRM2 P08172 2/20 0.31
CHRM4 P08173 2/20 0.31
L3MBTL1 Q9Y468 4/20 0.30
TDP1 Q9NUW8 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
SCHEMBL8308654 1.00 MAPK1 (0.33) MAPK1SMN1; SMN2NFKB1NFKB2RELA
SCHEMBL8308908 0.90 MAPK1 (0.33) MAPK1SMN1; SMN2ALDH1A1CHRM2CHRM4
SCHEMBL4516595 0.90 MAPK1 (0.33) MAPK1SMN1; SMN2ALDH1A1CHRM2CHRM4
SCHEMBL4524592 0.90 MAPK1 (0.33) MAPK1SMN1; SMN2ALDH1A1CHRM2CHRM4
SCHEMBL8309292 0.90 MAPK1 (0.33) MAPK1SMN1; SMN2ALDH1A1CHRM2CHRM4
SCHEMBL5792460 0.90 MAPK1 (0.33) MAPK1SMN1; SMN2ALDH1A1CHRM2CHRM4
SCHEMBL2797900 0.87 L3MBTL1 (0.36) MAPK1SMN1; SMN2CHRM2CHRM4L3MBTL1
SCHEMBL2792896 0.87 L3MBTL1 (0.36) MAPK1SMN1; SMN2CHRM2CHRM4L3MBTL1
SCHEMBL2793010 0.87 L3MBTL1 (0.36) MAPK1SMN1; SMN2CHRM2CHRM4L3MBTL1
SCHEMBL7478239 0.86 MEN1 (0.34) MAPK1SMN1; SMN2ALDH1A1CHRM2CHRM4

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