SCHEMBL9108868

SCHEMBL9108868

CC(C)n1ccc2cc(O)c(O)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.36
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
ALOX15 P16050 4/20 0.34
ALOX12 P18054 4/20 0.34
HTR2A P28223 4/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
ESR1 P03372 2/20 0.34
TP53 P04637 2/20 0.34
CYP3A4 P08684 2/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 2/20 0.34
RECQL P46063 2/20 0.34
KMT2A Q03164 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 2/20 0.34
NR1I2 O75469 1/20 0.34
GMNN O75496 1/20 0.34

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
SCHEMBL9504583 0.84 TYR (0.37) ALOX15KDM4EMEN1ALDH1A1CYP3A4
SCHEMBL21244767 0.78 KDM4E (0.39) MAPK14HTR2AKDM4EMEN1ALDH1A1
SCHEMBL15724412 0.78 HTR2C (0.41) MAPK11MAPK14HTR2AKDM4EMEN1
SCHEMBL15723823 0.78 MAPK11 (0.39) MAPK11MAPK14HTR2ABRD4CREBBP
SCHEMBL15723850 0.76 HTR2C (0.53) MAPK11MAPK14HTR2ACYP3A4CYP1A2
SCHEMBL15991500 0.74 SRC (0.37) ALOX15ALOX12KDM4EMEN1ALDH1A1
SCHEMBL108453 0.72 PRKCI (0.50) ACHEMAPTGPR35DAO
SCHEMBL29803376 0.72 PRKCI (0.50) ACHEMAPTGPR35DAO
SCHEMBL13204941 0.72 HTR2C (0.53) MAPK11MAPK14HTR2AALDH1A1NR1I2
SCHEMBL599047 0.72 HTR2A (0.53) HTR2ACYP1A2SLC6A2MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335477-B1 THE USE OF N-SUBSTITUTED-5,6-DIHYDROXYINDOLES AS A HAIR COLORING AGENT Bristol-Myers Squibb Company (US) 1993-07-21 EP claimed
EP-0335477-A2 The use of N-substituted-5,6-dihydroxyindoles as a hair coloring agent Bristol-Myers Squibb Company (US) 1989-10-04 EP claimed
US-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-08-29 US disclosed
EP-0637955-A4 HAIR DYEING COMPOSITIONS COMPRISED OF 5,6-DIHYDROXYINDOLE AND A CHLORITE OXIDANT AND METHODS OF DYEING THEREWITH. BRISTOL MYERS SQUIBB CO (US) 1995-11-08 EP disclosed
US-5413612-A Oxidation color dyes for hair and packages CLAIROL INCORPORATED (US) 1995-05-09 US disclosed
EP-0637955-A1 HAIR DYEING COMPOSITIONS COMPRISED OF 5,6-DIHYDROXYINDOLE AND A CHLORITE OXIDANT AND METHODS OF DYEING THEREWITH BRISTOL-MYERS SQUIBB COMPANY (US) 1995-02-15 EP disclosed
WO-1993021898-A1 HAIR DYEING COMPOSITIONS COMPRISED OF 5,6-DIHYDROXYINDOLE AND A CHLORITE OXIDANT AND METHODS OF DYEING THEREWITH BRISTOL-MYERS SQUIBB COMPANY (US) 1993-11-11 WO disclosed
EP-0335477-B1 THE USE OF N-SUBSTITUTED-5,6-DIHYDROXYINDOLES AS A HAIR COLORING AGENT Bristol-Myers Squibb Company (US) 1993-07-21 EP disclosed
EP-0335477-A2 The use of N-substituted-5,6-dihydroxyindoles as a hair coloring agent Bristol-Myers Squibb Company (US) 1989-10-04 EP 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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS POLRMT, EIF2AK2, NSUN3 ACHE 4595/4885MAPK11 4816/4885MAPK14 4539/4885

“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.