SCHEMBL5688201

SCHEMBL5688201

COc1ccc(-c2ccc(N)cc2O)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
ALDH1A1 P00352 3/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
FYN P06241 6/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KIT P10721 1/20 0.46
CHEK2 O96017 2/20 0.46
PRKCZ Q05513 1/20 0.46
PTGS2 P35354 1/20 0.46
CYP19A1 P11511 2/20 0.45

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
SCHEMBL6572286 0.88 KDM4E (0.49) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5688026 0.87 FYN (0.48) KDM4EALDH1A1MAPTFYNCHEK2
SCHEMBL6011581 0.84 KDM4E (0.51) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL6011444 0.81 FYN (0.51) ALDH1A1FYNHSD17B10CHEK2
SCHEMBL5685016 0.81 ALOX15 (0.50) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL6011308 0.80 TUBB4A (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL6573114 0.79 ALDH1A1 (0.53) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL94025 0.79 TSHR (0.58) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL30167101 0.79 TSHR (0.58) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5685506 0.79 MAPK1 (0.54) KDM4EALDH1A1MAPTMEN1KMT2A

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-7077872-B2 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives WELLA AG (DE) 2006-07-18 US disclosed
EP-1418879-B1 OXIDATION HAIR DYES CONTAINING 3-AMINOPHENOL DERIVATIVES, AND NOVEL 3-AMINOPHENOL DERIVATIVES WELLA AG (DE) 2006-04-12 EP disclosed
US-20040200010-A1 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives WELLA AKTIENGESELLSCHAFT (DE) 2004-10-14 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-20040200010-A1 Oxidation hair dyes containing 3-aminophenol derivatives, and novel 3-aminophenol derivatives KRT18, S100P, ALDH7A1 KDM4E 497/4885CNR1 2657/4885CNR2 2957/4885

“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.