SCHEMBL1230236

SCHEMBL1230236

Nc1cn(Cc2ccc(Cl)cc2)nc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44
NOTUM Q6P988 1/20 0.44
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
STAT3 P40763 1/20 0.40
IDO1 P14902 1/20 0.39
PTGS2 P35354 1/20 0.38
TNF P01375 1/20 0.38
CXCL8 P10145 1/20 0.38
SOS1 Q07889 1/20 0.38
NOD2 Q9HC29 1/20 0.38
NOD1 Q9Y239 1/20 0.38
ADORA3 P0DMS8 2/20 0.38

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
SCHEMBL8756843 0.83 ADORA2A (0.53) GAAKMT2AALDH1A1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL9325243 0.80 ADORA2A (0.50) GAAKMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL7258447 0.80 MEN1 (0.47) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL1569200 0.72 ALDH1A1 (0.54) POLBGAAGFERNOTUMKMT2A
SCHEMBL712713 0.70 MAPT (0.70) NOTUMKMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL2273175 0.70 POLB (0.44) POLBGAAGFERNOTUMKMT2A
SCHEMBL14327666 0.69 ADORA3 (0.49) GAANOTUMKMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL712415 0.69 MAPT (0.73) NOTUMKMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL17459093 0.69 RAB9A (0.48) POLBGAAGFERKMT2ASMN1; SMN2
SCHEMBL21523638 0.67 KMT2A (0.49) POLBKMT2AKDM4ESMN1; SMN2LMNA

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
CN-107361508-B Custom dyeing system 卡拉莱特有限公司 2020-11-03 CN disclosed
EP-2464424-A1 DYE COMPOSITION COMPRISING A HETEROCYCLIC OXIDATION BASE AND AN INDOLE COUPLER L'Oréal (FR) 2012-06-20 EP disclosed
EP-2337550-A2 METHOD FOR CONCEALING GRAY HAIRS Henkel AG & Co. KGaA (DE) 2011-06-29 EP disclosed
WO-2011018483-A1 DYE COMPOSITION COMPRISING A HETEROCYCLIC OXIDATION BASE AND AN INDOLE COUPLER L'OREAL (FR) 2011-02-17 WO disclosed
WO-2010046256-A2 METHOD FOR CONCEALING GRAY HAIRS HENKEL AG & CO. KGAA (DE) 2010-04-29 WO disclosed
WO-2010034626-A2 NOVEL DEVELOPER COMPONENTS HENKEL AG & CO. KGAA (DE) 2010-04-01 WO disclosed
WO-2009098257-A1 COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING AT LEAST ONE CATIONIC DIAMINO-N,N-DIHYDROPYRAZOLONE DERIVATIVE L'OREAL (FR) 2009-08-13 WO disclosed
EP-1137391-B1 METHOD FOR TREATING HAIR NOVOZYMES AS (DK) 2004-11-03 EP disclosed
US-6572843-B1 Combining permanent dyeing and straightening; applying to reduced hair an oxidizing enzyme (Laccase), a mediator, and a chemical oxidizing agent that produces hydrogen peroxide NOVOZYMES, A/S (DK) 2003-06-03 US disclosed