SCHEMBL5845273

SCHEMBL5845273

N#Cc1ccccc1-c1ccc(N)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.59
CYP3A4 P08684 4/20 0.52
HSD17B10 Q99714 3/20 0.52
ALOX15 P16050 1/20 0.52
AR P10275 3/20 0.47
PGR P06401 2/20 0.47
ALOX5AP P20292 1/20 0.46
FEN1 P39748 1/20 0.46
TRPA1 O75762 1/20 0.46
APP P05067 1/20 0.44
PTPN5 P54829 1/20 0.43
BRD4 O60885 1/20 0.42
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
CYP1A2 P05177 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CLK4 Q9HAZ1 2/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL7023813 0.84 ESR2 (0.55) ESR2CYP3A4HSD17B10ARPGR
SCHEMBL28871380 0.82 HSD17B10 (0.70) ESR2CYP3A4HSD17B10ALOX15APP
SCHEMBL3786765 0.78 HSD17B10 (0.64) ESR2CYP3A4HSD17B10ALOX15ALOX5AP
SCHEMBL3139052 0.78 ALOX15 (0.48) ESR2CYP3A4HSD17B10ALOX15AR
SCHEMBL2653323 0.77 ALOX5AP (0.56) ESR2CYP3A4HSD17B10ARPGR
SCHEMBL18263134 0.76 ESR2 (0.50) ESR2ARPGRALOX5APFEN1
SCHEMBL1532429 0.74 ESR2 (1.00) ESR2ARPGRTRPA1PTPN5
SCHEMBL4359377 0.74 ESR2 (0.66) ESR2CYP3A4HSD17B10ALOX5APFEN1
SCHEMBL23153733 0.74 PTPN5 (0.45) ESR2CYP3A4HSD17B10ARPGR
SCHEMBL7018615 0.74 TDP1 (0.58) ESR2CYP3A4ALOX15ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122061-B2 Agents for dyeing keratin fibers, containing 4-aminobiphenyl-3-ol-derivatives WELLA AG (DE) 2006-10-17 US claimed
EP-1562539-A1 AGENTS FOR DYEING KERATIN FIBERS, CONTAINING 4-AMINO-BIPHENYL-3-OL-DERIVATIVES Wella Aktiengesellschaft (DE) 2005-08-17 EP claimed
US-20050155160-A1 Agents for dyeing keratin fibers, containing 4-amino-biphenyl-3-ol-derivatives WELLA AKTIENGESELLSCHAFT (DE) 2005-07-21 US claimed
WO-2004041226-A1 AGENTS FOR DYEING KERATIN FIBERS, CONTAINING 4-AMINO-BIPHENYL-3-OL-DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2004-05-21 WO claimed
US-7122061-B2 Agents for dyeing keratin fibers, containing 4-aminobiphenyl-3-ol-derivatives WELLA AG (DE) 2006-10-17 US disclosed
EP-1562539-A1 AGENTS FOR DYEING KERATIN FIBERS, CONTAINING 4-AMINO-BIPHENYL-3-OL-DERIVATIVES Wella Aktiengesellschaft (DE) 2005-08-17 EP disclosed
US-20050155160-A1 Agents for dyeing keratin fibers, containing 4-amino-biphenyl-3-ol-derivatives WELLA AKTIENGESELLSCHAFT (DE) 2005-07-21 US disclosed
WO-2004041226-A1 AGENTS FOR DYEING KERATIN FIBERS, CONTAINING 4-AMINO-BIPHENYL-3-OL-DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2004-05-21 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-20050155160-A1 Agents for dyeing keratin fibers, containing 4-amino-biphenyl-3-ol-derivatives KRT18, CBR3, CCNB3 ESR2 2757/4885CYP3A4 835/4885HSD17B10 913/4885

“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.