SCHEMBL5377840

SCHEMBL5377840

CCOC(OCC)c1c(O)cc(O)c2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 6/20 0.38
GAA P10253 5/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 2/20 0.38
EP300 Q09472 1/20 0.38
ALOX5 P09917 1/20 0.38
CYP2D6 P10635 1/20 0.38
NPC1 O15118 1/20 0.38
RECQL P46063 1/20 0.38
TRPM4 Q8TD43 1/20 0.37
IDO1 P14902 3/20 0.36
KDM4E B2RXH2 5/20 0.35
MCL1 Q07820 3/20 0.35

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
SCHEMBL5394193 0.84 EP300 (0.44) MAPTKMT2AMEN1CYP3A4ALDH1A1
SCHEMBL5394234 0.78 MEN1 (0.50) HTTMAPTGAAKMT2AMEN1
SCHEMBL5386636 0.74 IDO1 (0.46) EP300ALOX5IDO1L3MBTL1
SCHEMBL21686451 0.74 AHR (0.48) HTTLMNAMAPTGAAKMT2A
SCHEMBL5388644 0.74 CA2 (0.44) LMNAMAPTCYP3A4ALDH1A1NPC1
SCHEMBL5388512 0.74 NR1H2 (0.42) KMT2AMEN1CYP3A4HPGDBCHE
SCHEMBL5378019 0.71 IDO1 (0.37) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL5380106 0.68 TSHR (0.55) HTTLMNAMAPTGAAKMT2A
SCHEMBL5382277 0.68 BCHE (0.35) LMNAMAPTKMT2AMEN1CYP3A4
SCHEMBL5384722 0.68 KDM4E (0.41) MAPTKMT2AMEN1CYP1A2CYP3A4

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
US-7300472-B2 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-27 US disclosed
US-20070000074-A1 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2007-01-04 US disclosed
EP-1534227-B1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KGAA (DE) 2006-12-27 EP disclosed
US-7105032-B2 Agents used for dyeing keratinous fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-09-12 US disclosed
US-20050144740-A1 Agents used for dyeing keratinous fibers HENKEL AG & CO. KGAA (DE) 2005-07-07 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 (2 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-20050144740-A1 Agents used for dyeing keratinous fibers KRT18, TUBB3, DSG1 HTT 1623/4885LMNA 803/4885MAPT 259/4885
US-20070000074-A1 Agents for coloring fibers containing keratin KRT18, COL1A1, CYC1 HTT 2426/4885LMNA 160/4885MAPT 2036/4885

“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.