SCHEMBL8036870

SCHEMBL8036870

Cn1nc(N)c(N)c1-c1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.44
CRHR1 P34998 1/20 0.42
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
HRH4 Q9H3N8 1/20 0.38
DPP4 P27487 3/20 0.38
DPP8 Q6V1X1 2/20 0.38
KDM4E B2RXH2 2/20 0.38
PLA2G7 Q13093 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.37
SCN10A Q9Y5Y9 1/20 0.37
BCHE P06276 1/20 0.37
IGF1R P08069 1/20 0.37
TLR8 Q9NR97 1/20 0.37
HSP90AA1 P07900 2/20 0.37

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
SCHEMBL8038694 0.80 TLR8 (0.41) HSD11B1CRHR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL8041070 0.79 ALDH1A1 (0.38) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL8036929 0.79 ALDH1A1 (0.39) HSD11B1CRHR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL8036852 0.77 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNADPP4KDM4E
SCHEMBL1802348 0.76 HSD11B1 (0.44) HSD11B1CRHR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL8041063 0.74 P2RX7 (0.46) ALDH1A1SMN1; SMN2LMNADPP4KDM4E
SCHEMBL8041064 0.74 GSK3B (0.46) ALDH1A1SMN1; SMN2NPC1LMNARAB9A
SCHEMBL12694219 0.74 HSD11B1 (0.50) HSD11B1CRHR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL8034829 0.72 GAA (0.46) ALDH1A1SMN1; SMN2LMNAHPGDMAPT
SCHEMBL8025221 0.71 HTT (0.46) CRHR1ALDH1A1SMN1; SMN2NPC1LMNA

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