SCHEMBL5701152

SCHEMBL5701152

CCOC(=O)c1ncc(CC)nc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.49
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 5/20 0.43
MAPT P10636 3/20 0.43
TP53 P04637 3/20 0.43
MAPK1 P28482 2/20 0.43
NPC1 O15118 2/20 0.43
HSD17B10 Q99714 2/20 0.43
XBP1 P17861 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TLR9 Q9NR96 1/20 0.43
CYP1A2 P05177 2/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GABRA2 P47869 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TARBP2 Q15633 2/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL10004053 0.82 CDC7 (0.47) KDM4EALDH1A1MAPTTP53MAPK1
SCHEMBL30811269 0.80 KDM4E (0.42) KDM4EALDH1A1MAPTTP53NPC1
SCHEMBL14398367 0.78 KDM4E (0.60) KDM4ECYP2C9CYP2C19ALDH1A1MAPT
SCHEMBL6929389 0.75 LMNA (0.45) ALDH1A1MAPTTP53MAPK1NPC1
SCHEMBL3979134 0.75 GABRP (0.41) ALDH1A1MAPTTP53NPC1GABRA2
SCHEMBL1625153 0.75 TDP1 (0.44) KDM4EALDH1A1MAPTTP53MAPK1
SCHEMBL28226938 0.75 TDP1 (0.37) KDM4EALDH1A1MAPTNPC1HSD17B10
SCHEMBL3868054 0.75 GABRP (0.41) GABRA2GABRB2GABRA1GABRG2GABRB3
SCHEMBL11853901 0.75 CYP1A2 (0.53) KDM4EALDH1A1MAPTTP53MAPK1
SCHEMBL2410980 0.73 HSP90AA1 (0.47) KDM4EALDH1A1MAPTTP53MAPK1

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-1105775-B1 POLYHALIDE PARTICLES AND LIGHT VALVES COMPRISING SAME RESEARCH FRONTIERS INC (US) 2006-09-06 EP disclosed
EP-1105775-A4 POLYHALIDE PARTICLES AND LIGHT VALVES COMPRISING SAME RESEARCH FRONTIERS INC (US) 2005-04-13 EP disclosed
US-6517746-B1 Polarizing material is a complex of (a) elemental iodine; (b) a hydrohalide acid or an ammonium, alkali metal or alkaline earth halide; (c) a pyrazine-2,5-dicarboxylic acid; and (d) a monoamide or monoester of a pyrazine-2,5-dicarboxylic acid RESEARCH FRONTIERS INCORPORATED 2003-02-11 US disclosed
EP-1105775-A1 POLYHALIDE PARTICLES AND LIGHT VALVES COMPRISING SAME RESEARCH FRONTIERS INCORPORATED (US) 2001-06-13 EP disclosed
WO-2000003178-A1 POLYHALIDE PARTICLES AND LIGHT VALVES COMPRISING SAME RESEARCH FRONTIERS INCORPORATED (US) 2000-01-20 WO disclosed