SCHEMBL1979184

SCHEMBL1979184

OCCNc1cccnc1NCCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
MAPK1 P28482 1/20 0.48
MAPT P10636 2/20 0.46
TNF P01375 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 1/20 0.41
GLA P06280 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
GRM5 P41594 1/20 0.39
POLB P06746 2/20 0.39
GAA P10253 1/20 0.39
LMNA P02545 2/20 0.38
RAD52 P43351 2/20 0.38
HTT P42858 1/20 0.38
FLT3 P36888 1/20 0.38
TYRO3 Q06418 1/20 0.38
MERTK Q12866 1/20 0.38

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
SCHEMBL1978099 0.89 HIF1A (0.44) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL1746875 0.87 KDM4E (0.44) KDM4EMAPK1MAPTTNFALDH1A1
SCHEMBL1977303 0.81 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10GRM5
SCHEMBL9639509 0.80 GRM5 (0.49) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL3846786 0.79 KDM4E (0.47) KDM4EMAPK1MAPTTNFALDH1A1
SCHEMBL29882733 0.79 KDM4E (0.47) KDM4EMAPK1MAPTTNFALDH1A1
SCHEMBL2943749 0.79 KDM4E (0.47) KDM4EMAPK1MAPTTNFALDH1A1
SCHEMBL7515463 0.79 MAPT (0.44) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL18356238 0.79 KDM4E (0.47) KDM4EMAPK1MAPTTNFALDH1A1
SCHEMBL7080994 0.79 FDPS (0.54) KDM4EMAPK1MAPTTNFALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1352629-B1 Use of a pyridine-dicarboxylic acid derivative or a salt thereof to stimulate or induce keratinic fiber growth and/or to prevent its loss OREAL (FR) 2011-06-22 EP claimed
EP-1352629-A1 Use of a pyridine-dicarboxylic acid derivative or a salt thereof to stimulate or induce keratinic fiber growth and/or to prevent its loss L'OREAL (FR) 2003-10-15 EP claimed
US-6399613-B1 N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES AVENTIS PHARMA S.A. (FR) 2002-06-04 US disclosed