SCHEMBL8468645

SCHEMBL8468645

COC(=O)OC1=C(C)N2CCCC2=C(OC(=O)OC)C1c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KDM4E B2RXH2 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.37
GPBAR1 Q8TDU6 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 2/20 0.36
CACNA1F O60840 1/20 0.35
CACNA1D Q01668 1/20 0.35
CACNA1S Q13698 1/20 0.35
CACNA1C Q13936 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.34
SLC6A2 P23975 5/20 0.33

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
SCHEMBL8319383 0.97 HPGD (0.43) HPGDNPSR1KDM4ESMN1; SMN2GPBAR1
SCHEMBL8321061 0.90 HPGD (0.41) HPGDNPSR1KDM4ESMN1; SMN2GPBAR1
SCHEMBL8462232 0.86 KDM4E (0.41) KDM4EALDH1A1POLBGAA
SCHEMBL8317255 0.83 GAA (0.45) HPGDNPSR1KDM4EALDH1A1POLB
SCHEMBL8323456 0.81 TSHR (0.39) HPGDNPSR1KDM4EALDH1A1GLA
SCHEMBL8318729 0.80 GAA (0.44) HPGDNPSR1KDM4EALDH1A1POLB
SCHEMBL8318029 0.79 ALDH1A1 (0.46) HPGDNPSR1KDM4EALDH1A1GLA
SCHEMBL8323687 0.75 HPGD (0.55) HPGDNPSR1KDM4ESMN1; SMN2GPBAR1
SCHEMBL8320504 0.74 CYP2C9 (0.37) HPGDNPSR1KDM4EALDH1A1GLA
SCHEMBL8318733 0.73 HPGD (0.43) HPGDNPSR1KDM4ESMN1; SMN2GPBAR1

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-0717043-B1 Use of 1,2-bridged 1,4-dihydropyridines as selective potassium channel modulators BAYER AG (DE) 1999-11-10 EP claimed
EP-0717043-A1 Use of 1,2-bridged 1,4-dihydropyridines as selective potassium channel modulators BAYER AG (DE) 1996-06-19 EP claimed