SCHEMBL8034793

SCHEMBL8034793

CCCn1nc(N)c(N)c1-c1ccccc1OC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.43
JAK2 O60674 1/20 0.40
ALDH1A1 P00352 4/20 0.40
ADORA2A P29274 2/20 0.39
KDM4E B2RXH2 2/20 0.38
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
GAA P10253 1/20 0.38
DPP4 P27487 3/20 0.37
PKM P14618 1/20 0.37
DRD2 P14416 1/20 0.37
HSP90AA1 P07900 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
SCHEMBL8036854 0.89 JAK2 (0.42) TLR8JAK2ALDH1A1ADORA2AKDM4E
SCHEMBL8025209 0.82 KDM4E (0.44) JAK2ALDH1A1ADORA2AKDM4ETSHR
SCHEMBL8036852 0.81 ALDH1A1 (0.49) JAK2ALDH1A1ADORA2AKDM4ETSHR
SCHEMBL8038694 0.80 TLR8 (0.41) TLR8ALDH1A1KDM4ETSHRSMN1; SMN2
SCHEMBL8041055 0.79 LMNA (0.47) ALDH1A1KDM4ETSHRSMN1; SMN2HSD17B10
SCHEMBL8025240 0.76 TSHR (0.46) TLR8ALDH1A1ADORA2ATSHRSMN1; SMN2
SCHEMBL8025164 0.75 ABL1 (0.45) JAK2ALDH1A1ADORA2AKDM4ETSHR
SCHEMBL8374661 0.75 HSD17B10 (0.43) TLR8JAK2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL8025272 0.74 ALDH1A1 (0.43) TLR8ALDH1A1KDM4ETSHRHSD17B10
SCHEMBL8036883 0.73 TLR8 (0.46) TLR8ADORA2AKDM4EKMT2AMAPK1

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