SCHEMBL5447196

SCHEMBL5447196

Oc1ccc2[nH]ccc2c1.Oc1ccc2cc[nH]c2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.84
USP2 O75604 1/20 0.84
GAA P10253 1/20 0.84
ALOX15 P16050 1/20 0.84
RAD51 Q06609 1/20 0.84
NPSR1 Q6W5P4 1/20 0.84
MAOB P27338 1/20 0.50
ENPP2 Q13822 2/20 0.48
AHR P35869 7/20 0.48
NR4A2 P43354 2/20 0.48
CYP2A6 P11509 1/20 0.48
CMA1 P23946 1/20 0.48
F7 P08709 1/20 0.48
LTA4H P09960 1/20 0.48
F3 P13726 1/20 0.48
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GUSB P08236 2/20 0.47

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
SCHEMBL34240 0.92 TYR (1.00) TYRUSP2GAAALOX15RAD51
SCHEMBL29355861 0.92 TYR (1.00) TYRUSP2GAAALOX15RAD51
SCHEMBL50566 0.92 USP2 (1.00) TYRUSP2GAAALOX15RAD51
SCHEMBL29440252 0.92 USP2 (1.00) TYRUSP2GAAALOX15RAD51
Water SCHEMBL28220544 0.90 USP2 (0.95) TYRUSP2GAAALOX15RAD51
Hydrochloric Acid SCHEMBL4718421 0.90 USP2 (0.95) TYRUSP2GAAALOX15RAD51
Bromide SCHEMBL6029763 0.90 USP2 (0.95) TYRUSP2GAAALOX15RAD51
Indole SCHEMBL4974902 0.86 USP2 (0.81) TYRUSP2GAAALOX15RAD51
SCHEMBL8187780 0.84 MEN1 (0.73) TYRUSP2GAAALOX15RAD51
Sulfuric Acid SCHEMBL23541029 0.82 TYR (0.81) TYRUSP2GAAALOX15RAD51

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0943614-B1 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives WELLA AG (DE) 2001-12-12 EP claimed
EP-1846108-A2 KERATIN DYEING COMPOSITIONS CONTAINING BENZOTHIAZOLE-4,7-DIAMINES, AND USE THEREOF The Procter & Gamble Company (US) 2007-10-24 EP disclosed
US-20070050923-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof WELLA OPERATIONS US, LLC 2007-03-08 US disclosed
WO-2006078800-A2 KERATIN DYEING COMPOSITIONS CONTAINING BENZOTHIAZOLE-4-, 7-DIAMINES, AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2006-07-27 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-20070050923-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, NOX5, JUP TYR 577/4885USP2 2593/4885GAA 4125/4885

“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.