SCHEMBL8320504

SCHEMBL8320504

COC(=O)OC1=C2CCCN2C(C)=C(C(C)=O)C1c1cccc(Cl)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.37
KDM4E B2RXH2 3/20 0.37
HSD17B10 Q99714 3/20 0.37
TSHR P16473 3/20 0.37
MEN1 O00255 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
KMT2A Q03164 2/20 0.37
HIF1A Q16665 2/20 0.37
ABCB11 O95342 2/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 2/20 0.37
TP53 P04637 1/20 0.37
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
THPO P40225 1/20 0.37
NR1I2 O75469 1/20 0.37

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
SCHEMBL8323456 0.91 TSHR (0.39) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8195792 0.85 KDM4E (0.48) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8321979 0.84 CYP2C9 (0.38) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8321061 0.82 HPGD (0.41) KDM4EHSD17B10LMNAALDH1A1HPGD
SCHEMBL8321322 0.82 KMT2A (0.39) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8441926 0.80 TSHR (0.42) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8320521 0.79 KMT2A (0.38) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8325253 0.78 KMT2A (0.39) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8322440 0.76 CYP2C9 (0.38) CYP2C9KDM4EHSD17B10TSHRMEN1
SCHEMBL8089331 0.75 MAPT (0.41) CYP2C9KDM4EHSD17B10TSHRMEN1

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 5 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
EP-0717043-B1 Use of 1,2-bridged 1,4-dihydropyridines as selective potassium channel modulators BAYER AG (DE) 1999-11-10 EP disclosed
EP-0924211-A2 1,2 bridged 1,4-dihydropyridines as selective potassium channel modulators Bayer Aktiengesellschaft (DE) 1999-06-23 EP disclosed
EP-0717043-A1 Use of 1,2-bridged 1,4-dihydropyridines as selective potassium channel modulators BAYER AG (DE) 1996-06-19 EP disclosed