SCHEMBL8323187

SCHEMBL8323187

COC(=O)C1=C2CCCN2C2=C(C(=O)CCC2)C1c1cccc([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
CYP3A4 P08684 5/20 0.53
CYP2C9 P11712 5/20 0.53
ELANE P08246 3/20 0.53
HIF1A Q16665 3/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 3/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
CYP2D6 P10635 2/20 0.46
TSHR P16473 2/20 0.46
NFKB1 P19838 2/20 0.46
POLB P06746 2/20 0.46
MAPK1 P28482 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
THPO P40225 1/20 0.46
NR3C2 P08235 1/20 0.46
GMNN O75496 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL8192331 0.97 MEN1 (0.53) MEN1KMT2ACYP3A4CYP2C9ELANE
SCHEMBL8323888 0.86 KMT2A (0.49) MEN1KMT2ACYP3A4CYP2C9ELANE
SCHEMBL8319136 0.84 KMT2A (0.48) MEN1KMT2ACYP3A4CYP2C9ELANE
SCHEMBL11724369 0.81 MAPT (0.55) MEN1KMT2ACYP3A4CYP2C9HIF1A
SCHEMBL11729475 0.80 CYP1A2 (0.66) MEN1KMT2ACYP3A4CYP2C9HIF1A
SCHEMBL8319794 0.78 POLB (0.47) MEN1KMT2ACYP3A4CYP2C9ELANE
SCHEMBL11725221 0.76 CYP1A2 (0.64) MEN1KMT2ACYP3A4CYP2C9HIF1A
SCHEMBL11727265 0.76 CYP1A2 (0.64) MEN1KMT2ACYP3A4CYP2C9HIF1A
SCHEMBL8319747 0.75 POLB (0.46) MEN1KMT2ACYP3A4CYP2C9CYP1A2
SCHEMBL5233956 0.75 KMT2A (0.58) MEN1KMT2ACYP3A4CYP2C9ELANE

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 1 patent. 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