SCHEMBL5684882

SCHEMBL5684882

Nc1ccc(-c2cccnc2)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.59
MKNK1 Q9BUB5 2/20 0.59
MKNK2 Q9HBH9 2/20 0.59
MEN1 O00255 1/20 0.59
PSIP1 O75475 1/20 0.59
CYP11B1 P15538 5/20 0.55
CYP11B2 P19099 4/20 0.55
CYP19A1 P11511 2/20 0.55
CYP3A4 P08684 3/20 0.50
CYP2A6 P11509 2/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
TDO2 P48775 1/20 0.50
MAPT P10636 2/20 0.49
HTT P42858 1/20 0.49
CYP17A1 P05093 2/20 0.46
NTRK1 P04629 1/20 0.46
PIK3CA P42336 1/20 0.46
DYRK1A Q13627 1/20 0.46
IKBKB O14920 1/20 0.46

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
Hydrochloric Acid SCHEMBL5687723 0.98 AXL (0.58) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL16405695 0.87 AXL (0.61) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL3094447 0.82 AXL (0.56) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL21044098 0.82 AXL (0.56) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL16405691 0.82 MKNK1 (0.56) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL28094552 0.82 AXL (0.56) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL145074 0.81 AXL (0.59) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL5684846 0.81 CYP3A4 (0.44) AXLMKNK1MKNK2MEN1PSIP1
SCHEMBL1847280 0.81 NPC1 (0.63) CYP11B1CYP11B2CYP19A1CYP3A4CYP2A6
Hydrochloric Acid SCHEMBL6739740 0.80 AXL (0.58) AXLMKNK1MKNK2MEN1PSIP1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7077872-B2 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives WELLA AG (DE) 2006-07-18 US claimed
EP-1418879-B1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES WELLA AG (DE) 2006-04-12 EP claimed
US-20040200010-A1 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives WELLA AKTIENGESELLSCHAFT (DE) 2004-10-14 US claimed
EP-1418879-A1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES Wella Aktiengesellschaft (DE) 2004-05-19 EP claimed
WO-2003017955-A1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2003-03-06 WO claimed
US-7077872-B2 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives WELLA AG (DE) 2006-07-18 US disclosed
EP-1418879-B1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES WELLA AG (DE) 2006-04-12 EP disclosed
US-20040200010-A1 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives WELLA AKTIENGESELLSCHAFT (DE) 2004-10-14 US disclosed
EP-1418879-A1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES Wella Aktiengesellschaft (DE) 2004-05-19 EP disclosed
WO-2003017955-A1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2003-03-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040200010-A1 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives KRT18, S100P, ALDH7A1 AXL 2053/4885MKNK1 2749/4885MKNK2 2698/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.