SCHEMBL5843815

SCHEMBL5843815

Nc1ccc(-c2cccc(F)c2F)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
PGR P06401 2/20 0.42
APP P05067 2/20 0.41
ACMSD Q8TDX5 1/20 0.41
DYRK1A Q13627 4/20 0.40
HSD17B1 P14061 2/20 0.39
HSD17B2 P37059 2/20 0.39
BACE1 P56817 2/20 0.38
CNR2 P34972 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
WNT1 P04628 3/20 0.37
BRD4 O60885 1/20 0.36
HSD17B14 Q9BPX1 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL26832646 0.86 ALDH1A1 (0.50) CYP3A4ALOX15HSD17B10PGRAPP
SCHEMBL5843391 0.86 ALOX15 (0.57) CYP3A4ALOX15HSD17B10PGRAPP
SCHEMBL29878768 0.86 ALOX15 (0.57) CYP3A4ALOX15HSD17B10PGRAPP
SCHEMBL29655217 0.84 MEN1 (0.48) PGRAPPDYRK1ABACE1CNR2
SCHEMBL5843816 0.83 CYP3A4 (0.50) CYP3A4ALOX15HSD17B10APPACMSD
SCHEMBL5844791 0.83 CYP3A4 (0.50) CYP3A4ALOX15HSD17B10APPBACE1
SCHEMBL5843592 0.83 CYP3A4 (0.50) CYP3A4ALOX15HSD17B10APPBACE1
SCHEMBL5843520 0.83 CYP3A4 (0.50) CYP3A4ALOX15HSD17B10APPACMSD
SCHEMBL5843774 0.80 ALOX15 (0.59) CYP3A4ALOX15HSD17B10APPHSD17B1
SCHEMBL28871380 0.79 HSD17B10 (0.70) CYP3A4ALOX15HSD17B10APPBACE1

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
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
US-20050155160-A1 Agents for dyeing keratin fibers, containing 4-amino-biphenyl-3-ol-derivatives WELLA AKTIENGESELLSCHAFT (DE) 2005-07-21 US 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 CYP3A4 835/4885ALOX15 3006/4885HSD17B10 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.