SCHEMBL8034995

SCHEMBL8034995

CCc1c(N)c(N)nn1Cc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
GFER P55789 1/20 0.54
POLB P06746 1/20 0.50
PTGDR2 Q9Y5Y4 5/20 0.44
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 3/20 0.42
STAT3 P40763 1/20 0.42
TSHR P16473 1/20 0.39
SLC2A1 P11166 1/20 0.39
KDM4E B2RXH2 1/20 0.37
PDE8B O95263 1/20 0.36
TP53 P04637 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
SLC22A1 O15245 1/20 0.36
ALDH1A1 P00352 1/20 0.36
DHFR P00374 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL8038867 0.85 GAA (0.51) GAAGFERPOLBPTGDR2MAPT
SCHEMBL8036819 0.85 KDM4E (0.53) GAAPOLBPTGDR2MAPTSMN1; SMN2
SCHEMBL8038819 0.84 GAA (0.50) GAAGFERPOLBPTGDR2MAPT
SCHEMBL8035176 0.80 GAA (0.76) GAAGFERPOLBPTGDR2MAPT
SCHEMBL8038817 0.76 GAA (0.53) GAAGFERPOLBPTGDR2MAPT
SCHEMBL8038668 0.76 GAA (0.53) GAAGFERPOLBMAPTSMN1; SMN2
SCHEMBL8041057 0.75 GAA (0.51) GAAGFERPOLBMAPTSMN1; SMN2
SCHEMBL8041029 0.73 SMN1; SMN2 (0.59) GAAGFERPOLBMAPTSMN1; SMN2
SCHEMBL8038828 0.73 ILK (0.32)
SCHEMBL8034988 0.72 SMN1; SMN2 (0.57) GAAGFERPOLBPTGDR2MAPT

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 7 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