SCHEMBL8036854

SCHEMBL8036854

CCn1nc(N)c(N)c1-c1ccccc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.42
ALDH1A1 P00352 4/20 0.41
ADORA2A P29274 2/20 0.40
KDM4E B2RXH2 2/20 0.40
TLR8 Q9NR97 1/20 0.40
HSD17B10 Q99714 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
DPP4 P27487 1/20 0.39
HSP90AA1 P07900 2/20 0.38
HSP90AB1 P08238 1/20 0.38
ILK Q13418 1/20 0.37
NPSR1 Q6W5P4 1/20 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
SCHEMBL8034793 0.89 TLR8 (0.43) JAK2ALDH1A1ADORA2AKDM4ETLR8
SCHEMBL8025209 0.85 KDM4E (0.44) JAK2ALDH1A1ADORA2AKDM4EGAA
SCHEMBL8041055 0.81 LMNA (0.47) ALDH1A1KDM4EHSD17B10GAATSHR
SCHEMBL8036852 0.80 ALDH1A1 (0.49) JAK2ALDH1A1ADORA2AKDM4EHSD17B10
SCHEMBL8036929 0.79 ALDH1A1 (0.39) ALDH1A1KDM4ETLR8HSD17B10GAA
SCHEMBL8025164 0.78 ABL1 (0.45) JAK2ALDH1A1ADORA2AKDM4EHSD17B10
SCHEMBL13270276 0.77 ALDH1A1 (0.45) JAK2ALDH1A1ADORA2AKDM4ETLR8
SCHEMBL8034838 0.74 HTR2A (0.48) ALDH1A1ADORA2AKDM4EHSD17B10GAA
SCHEMBL8373919 0.73 HSD17B10 (0.46) JAK2ALDH1A1KDM4ETLR8HSD17B10
SCHEMBL8038834 0.73 USP7 (0.43) ALDH1A1KDM4ETLR8HSD17B10SMN1; 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 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
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