SCHEMBL8034829

SCHEMBL8034829

Nc1nn(Cc2ccc(Cl)cc2)c(-c2ccccc2Cl)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
LMNA P02545 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAPT P10636 2/20 0.45
STAT3 P40763 1/20 0.45
TDO2 P48775 1/20 0.43
POLB P06746 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
TNF P01375 1/20 0.40
CXCL8 P10145 1/20 0.40
SOS1 Q07889 1/20 0.40
NOD2 Q9HC29 1/20 0.40
NOD1 Q9Y239 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
NR1H2 P55055 1/20 0.39

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
SCHEMBL8041063 0.91 P2RX7 (0.46) GAALMNASMN1; SMN2MEN1KMT2A
SCHEMBL8041055 0.83 LMNA (0.47) GAAGFERLMNASMN1; SMN2MEN1
SCHEMBL8034988 0.82 SMN1; SMN2 (0.57) GAAGFERLMNASMN1; SMN2MEN1
SCHEMBL8036929 0.81 ALDH1A1 (0.39) GAALMNASMN1; SMN2MEN1KMT2A
SCHEMBL8041057 0.80 GAA (0.51) GAAGFERLMNASMN1; SMN2MEN1
SCHEMBL8041049 0.79 NR1H3 (0.54) GAAGFERLMNASMN1; SMN2MEN1
SCHEMBL8038694 0.78 TLR8 (0.41) GAALMNASMN1; SMN2MEN1KMT2A
SCHEMBL8041029 0.74 SMN1; SMN2 (0.59) GAAGFERLMNASMN1; SMN2MEN1
SCHEMBL8025162 0.73 SMN1; SMN2 (0.48) GAAGFERLMNASMN1; SMN2MEN1
SCHEMBL8025209 0.72 KDM4E (0.44) GAAGFERKMT2APOLBALDH1A1

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 5 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