SCHEMBL5049514

SCHEMBL5049514

CC1=C(c2ccccc2)N=NC1=O.Cc1cc(=O)n(-c2ccccc2)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.48
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 6/20 0.48
KMT2A Q03164 6/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
GAA P10253 8/20 0.48
HTT P42858 6/20 0.48
MEN1 O00255 4/20 0.48
LMNA P02545 6/20 0.46
RECQL P46063 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.43
POLB P06746 1/20 0.43
BLM P54132 1/20 0.43
ATM Q13315 1/20 0.43
ALKBH3 Q96Q83 1/20 0.41
ALOX15 P16050 1/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
RAD51 Q06609 1/20 0.39

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
SCHEMBL9150171 0.81 ALDH1A1 (0.68) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL5425653 0.81 ALDH1A1 (0.68) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL34121 0.81 ALDH1A1 (0.68) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL23907023 0.78 MAPT (0.65) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
Methyl Alcohol SCHEMBL1028813 0.78 MAPT (0.69) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL214204 0.78 L3MBTL1 (0.36) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL7164529 0.77 ALDH1A1 (0.58) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL11119546 0.71 MAPT (0.51) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL4414748 0.70 ALDH1A1 (0.44) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL11056522 0.69 MAPT (0.51) MAPTKDM4EALDH1A1KMT2ASMN1; SMN2

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
WO-2008149005-A2 DYE COMPOSITION COMPRISING AN AMINOPYRAZOLOPYRIDINE OXIDATION BASE AND A SOURCE OF CARBONATE IONS L'OREAL (FR) 2008-12-11 WO disclosed
EP-1992330-A2 Process for colouring keratinous fibres comprising the application of an aminopyrazolopyridine oxidation base in the absence of oxidizing agent L'Oreal (FR) 2008-11-19 EP disclosed
EP-1992329-A1 Dyeing composition comprising an aminopyrazolopyridine oxidation base and a specific associative polymer L'Oréal (FR) 2008-11-19 EP disclosed