SCHEMBL5665183

SCHEMBL5665183

CCN(C(=O)[CH]c1ccccn1)C(C)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
CHRM2 P08172 3/20 0.35
CHRM4 P08173 3/20 0.35
CHRM5 P08912 3/20 0.35
CHRM1 P11229 3/20 0.35
CHRM3 P20309 3/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
KEAP1 Q14145 1/20 0.34

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
SCHEMBL5010041 0.79 NPC1 (0.43) ALDH1A1HPGDKMT2ANPC1MEN1
SCHEMBL5664570 0.78 ALDH1A1 (0.40) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL5664796 0.76 TUBB4A (0.39) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL5664934 0.74 CHRM2 (0.40) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL5664609 0.71 CYP1A2 (0.43) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL176731 0.71 MEN1 (0.56) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL5663580 0.70 CHRM2 (0.44) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL5664584 0.70 KDM4E (0.40) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL5664722 0.69 ALDH1A1 (0.40) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL14152063 0.69 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10CYP1A2

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-1716137-A1 SUBSTITUTED QUINOLINE COMPOUNDS Pfizer Products Incorporated (US) 2006-11-02 EP disclosed
WO-2005080373-A1 SUBSTITUTED QUINOLINE COMPOUNDS PFIZER PRODUCTS INC. (US) 2005-09-01 WO disclosed