SCHEMBL8034985

SCHEMBL8034985

COc1ccccc1-c1[nH]nc(N)c1N

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
HSD17B10 Q99714 2/20 0.54
GAA P10253 1/20 0.54
FYN P06241 9/20 0.50
KDM4E B2RXH2 2/20 0.47
DCUN1D1 Q96GG9 1/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
PPARG P37231 1/20 0.45
KMT2A Q03164 1/20 0.45
NCOA2 Q15596 1/20 0.45
NCOA1 Q15788 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
METAP2 P50579 1/20 0.45
ALPL P05186 1/20 0.44
HSP90AA1 P07900 1/20 0.42
HTR7 P34969 1/20 0.42
HTR2B P41595 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
SCHEMBL17731011 0.75 ALDH1A1 (0.57) ALDH1A1HSD17B10GAAKDM4EMEN1
SCHEMBL12523000 0.75 KDM4E (0.48) ALDH1A1HSD17B10GAAFYNKDM4E
SCHEMBL8034891 0.74 JAK2 (0.51) ALDH1A1HSD17B10GAAKDM4EDCUN1D1
SCHEMBL16680793 0.73 KDR (0.56) ALDH1A1HSD17B10GAAKDM4E
SCHEMBL12907240 0.71 JAK2 (0.63) ALDH1A1HSD17B10GAA
SCHEMBL4494105 0.71 SCN5A (0.62) ALDH1A1HSD17B10GAA
SCHEMBL8117771 0.70 FYN (0.48) ALDH1A1HSD17B10GAAFYNKDM4E
SCHEMBL23611724 0.70 HSD17B10 (1.00) ALDH1A1HSD17B10GAAKDM4EDCUN1D1
SCHEMBL29930877 0.70 HSD17B10 (1.00) ALDH1A1HSD17B10GAAKDM4EDCUN1D1
SCHEMBL1528336 0.70 ALDH1A1 (0.58) ALDH1A1HSD17B10GAAKDM4EDCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6090162-A THE META-AMINOPHENOL IS HALOGENATED AT THE ORTHO POSITION OF THE PHENOL AS A COUPLER; DYEING USING THIS COMPOSITION WITH AN OXIDIZING AGENT; MULTICOMPARTMENT DYE KIT; USE AS HAIR DYE RESISTANT TO LIGHT, SHAMPOO, PERM TREATMENTS L'OREAL S.A. (FR) 2000-07-18 US claimed
EP-0919221-A1 Oxidative dyeing composition for keratinic fibres containing a substituted 3,4 diaminopyrazole-5 and a halogenated meta-aminophenol and dyeing process L'OREAL (FR) 1999-06-02 EP claimed
EP-0900206-A1 NEW DIAMINO PYRAZOLS, THEIR SYNTHESIS, KERATIN FIBRE DYEING COMPOSITIONS CONTAINING THEM, KERATIN FIBRE DYEING METHODS L'OREAL (FR) 1999-03-10 EP claimed
WO-1997042173-A1 NEW DIAMINO PYRAZOLS, THEIR SYNTHESIS, KERATIN FIBRE DYEING COMPOSITIONS CONTAINING THEM, KERATIN FIBRE DYEING METHODS L'OREAL (FR) 1997-11-13 WO claimed
US-6118008-A FIBER-REACTIVE DYE; HAIR DYE L'OREAL (FR) 2000-09-12 US disclosed
US-6090162-A THE META-AMINOPHENOL IS HALOGENATED AT THE ORTHO POSITION OF THE PHENOL AS A COUPLER; DYEING USING THIS COMPOSITION WITH AN OXIDIZING AGENT; MULTICOMPARTMENT DYE KIT; USE AS HAIR DYE RESISTANT TO LIGHT, SHAMPOO, PERM TREATMENTS L'OREAL S.A. (FR) 2000-07-18 US disclosed
EP-0919221-A1 Oxidative dyeing composition for keratinic fibres containing a substituted 3,4 diaminopyrazole-5 and a halogenated meta-aminophenol and dyeing process L'OREAL (FR) 1999-06-02 EP disclosed
EP-0900206-A1 NEW DIAMINO PYRAZOLS, THEIR SYNTHESIS, KERATIN FIBRE DYEING COMPOSITIONS CONTAINING THEM, KERATIN FIBRE DYEING METHODS L'OREAL (FR) 1999-03-10 EP disclosed
WO-1997042173-A1 NEW DIAMINO PYRAZOLS, THEIR SYNTHESIS, KERATIN FIBRE DYEING COMPOSITIONS CONTAINING THEM, KERATIN FIBRE DYEING METHODS L'OREAL (FR) 1997-11-13 WO disclosed