SCHEMBL4862349

SCHEMBL4862349

Oc1ccc(O)c(O)c1.Oc1ccc(O)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.60
APP P05067 1/20 0.56
TYR P14679 2/20 0.52
LCK P06239 2/20 0.52
NQO2 P16083 1/20 0.52
CES2 O00748 1/20 0.50
TRPA1 O75762 1/20 0.50
ALOX15 P16050 2/20 0.48
IGF1R P08069 1/20 0.48
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
ALDH1A1 P00352 2/20 0.48
CA12 O43570 2/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA14 Q9ULX7 2/20 0.48
NR1I2 O75469 1/20 0.48
LMNA P02545 1/20 0.48
CYP2C9 P11712 1/20 0.48
MIF P14174 1/20 0.48

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
SCHEMBL29829218 1.00
SCHEMBL33527 1.00
SCHEMBL6676690 0.97 ALOX5 (0.57) ALOX5APPTYRLCKNQO2
Phosphine SCHEMBL11514630 0.97 ALOX5 (0.57) ALOX5APPTYRLCKNQO2
Hydrogen Sulfide SCHEMBL11691776 0.97 ALOX5 (0.57) ALOX5APPTYRLCKNQO2
SCHEMBL31122728 0.97 ALOX5 (0.57) ALOX5APPTYRLCKNQO2
Phloroglucinol SCHEMBL8997011 0.94 ALOX5 (0.55) ALOX5APPTYRLCKNQO2
Benzene SCHEMBL21834592 0.94 ALOX5 (0.56) ALOX5APPTYRLCKNQO2
Ethane SCHEMBL28874992 0.94 ALOX5 (0.55) ALOX5APPTYRLCKNQO2
Formaldehyde SCHEMBL732503 0.91 ALOX5 (0.52) ALOX5APPTYRLCKNQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7431742-B2 Hair coloring kits and methods of use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-10-07 US disclosed
US-20070251025-A1 Hair coloring kits and methods of use thereof THE PROCTER & GAMBLE COMPANY 2007-11-01 US disclosed
US-4598114-A BINDER, TRIHYDROXYBENZENE, NEUTRALITY INGENIEURBURO LEUENBERGER AG (CH) 1986-07-01 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-20070251025-A1 Hair coloring kits and methods of use thereof COXFA4L2, SQOR, GPX4 ALOX5 801/4885APP 988/4885TYR 17/4885

“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.