SCHEMBL8936155

SCHEMBL8936155

Cc1cc(Cl)nc2cc(Cl)ccc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.72
NR4A2 P43354 1/20 0.53
KDM4E B2RXH2 2/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
HIF1A Q16665 1/20 0.51
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
PKM P14618 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MPO P05164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
BCHE P06276 2/20 0.44
ACHE P22303 2/20 0.44
CHRM1 P11229 1/20 0.44
EPHX2 P34913 1/20 0.44
TP53 P04637 2/20 0.42
MAPT P10636 1/20 0.42
KMO O15229 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL2538783 0.84 KDM4E (0.66) POLBKDM4ECYP3A4CYP2C19HIF1A
SCHEMBL6492060 0.84 POLB (1.00) POLBNR4A2KDM4EKMT2AMEN1
SCHEMBL3420261 0.84 POLB (0.52) POLBKDM4ECYP3A4CYP2C19HIF1A
SCHEMBL7424524 0.81 CYP2C19 (0.49) POLBKDM4ECYP3A4CYP2C19HIF1A
SCHEMBL5434270 0.81 KDM4E (0.50) POLBKDM4ECYP3A4CYP2C19HIF1A
SCHEMBL1600117 0.81 KDM4E (0.49) POLBNR4A2KDM4ECYP3A4CYP2C19
SCHEMBL3060777 0.81 KDM4E (0.49) POLBNR4A2KDM4ECYP3A4CYP2C19
SCHEMBL5437258 0.81 KDM4E (0.49) POLBNR4A2KDM4ECYP3A4CYP2C19
SCHEMBL29893224 0.81 KDM4E (0.49) POLBNR4A2KDM4ECYP3A4CYP2C19
SCHEMBL5638415 0.79 POLB (0.50) POLBNR4A2KMT2AMPOALDH1A1

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
US-5510338-A ADMINISTERING TO A MAMMAL TO RELIEVE PAIN AND TO TREAT CONVULSIONS, CEREBRAL ISCHEMIC DAMAGE, AND EMESIS GUILFORD PHARMACEUTICALS INC. (US) 1996-04-23 US disclosed
US-5342946-A Phosphonoalkylquinolin-2-ones as novel antagonists of non-NMDA ionotropic excitatory amino acid receptors GUILFORD PHARMACEUTICALS INC. (US) 1994-08-30 US disclosed