SCHEMBL4050171

SCHEMBL4050171

CCN(O)c1cccc(C)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TRPA1 O75762 2/20 0.45
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
CYP3A4 P08684 5/20 0.37
LMNA P02545 3/20 0.37
TSHR P16473 1/20 0.36
ATM Q13315 1/20 0.35
MAPT P10636 3/20 0.35
MAPK1 P28482 1/20 0.35
MC4R P32245 1/20 0.35
SCN4A P35499 1/20 0.35
MC3R P41968 1/20 0.35
HTR3A P46098 1/20 0.35
SCN5A Q14524 1/20 0.35
SCN9A Q15858 1/20 0.35
SCN3A Q9NY46 1/20 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
SCHEMBL9765433 0.82 ALDH1A1 (0.52) ALDH1A1TRPA1GABRA1GABRB2KDM4E
SCHEMBL2831816 0.81 LMNA (0.47) ALDH1A1KDM4ECYP3A4LMNATSHR
SCHEMBL145123 0.79 CYP3A4 (0.33) ALDH1A1TRPA1GABRA1GABRB2HPGD
SCHEMBL27476358 0.78 HSP90AA1 (0.36) ALDH1A1GABRA1GABRB2KDM4EHSD17B10
SCHEMBL3879393 0.76 TRPA1 (0.45) ALDH1A1TRPA1GABRA1GABRB2KDM4E
SCHEMBL28373135 0.76 LMNA (0.34) ALDH1A1KDM4ECYP3A4LMNATSHR
SCHEMBL673430 0.74 ALDH1A1 (0.59) ALDH1A1TRPA1GABRA1GABRB2KDM4E
SCHEMBL9436336 0.73 ALDH1A1 (0.42) ALDH1A1TRPA1GABRA1GABRB2KDM4E
Propane SCHEMBL27536178 0.73 ALDH1A1 (0.82) ALDH1A1TRPA1GABRA1GABRB2KDM4E
Propane SCHEMBL11575912 0.73 ALDH1A1 (0.82) ALDH1A1TRPA1GABRA1GABRB2KDM4E

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
CN-105385185-B Clean preparation method of weakly alkaline arylamine azo disperse dye 大连理工大学 2017-12-05 CN claimed
CN-105385185-B Clean preparation method of weakly alkaline arylamine azo disperse dye 大连理工大学 2017-12-05 CN disclosed
EP-2020252-A1 Process for colouring and permanent shaping keratin fibres KPSS-Kao Professional Salon Services GmbH (DE) 2009-02-04 EP disclosed
US-20020164741-A1 Non-aqueous, liquid, enzyme-containing compositions NOVOZYMES A/S (DK) 2002-11-07 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 (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-20020164741-A1 Non-aqueous, liquid, enzyme-containing compositions CNDP2, NOTUM, BCHE ALDH1A1 340/4885TRPA1 4734/4885GABRA1 4021/4885

“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.