SCHEMBL16330367

SCHEMBL16330367

CCCCN(CCCC)c1ccc(/N=C2\C=C(C)C(=O)C(Cl)=C2N)cc1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.35
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33
NR1H2 P55055 2/20 0.31
NR1H3 Q13133 2/20 0.31
AR P10275 2/20 0.30
NR1I2 O75469 1/20 0.30

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
SCHEMBL1153978 0.97 PABPC1 (0.34) PABPC1EGFRERBB2
SCHEMBL12052188 0.97 PABPC1 (0.34) PABPC1EGFRERBB2
SCHEMBL1153979 0.97 PABPC1 (0.34) PABPC1EGFRERBB2
SCHEMBL12052179 0.88 PABPC1 (0.33) PABPC1
SCHEMBL1153946 0.87 PABPC1 (0.36) PABPC1
SCHEMBL1153944 0.87 PABPC1 (0.36) PABPC1
SCHEMBL12052167 0.87 PABPC1 (0.36) PABPC1
Hydrochloric Acid SCHEMBL1154108 0.87 PABPC1 (0.33) PABPC1
Hydrochloric Acid SCHEMBL1154109 0.87 PABPC1 (0.33) PABPC1
SCHEMBL12428495 0.85 PABPC1 (0.36) PABPC1EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8083809-B2 Azomethine direct dyes or reduced precursors of these dyes obtained from 2-chloro-3-amino-6-methylphenol, and hair dyeing method starting from these dyes and precursors L'OREAL S.A. (FR) 2011-12-27 US disclosed
US-20110041261-A1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF THESE DYES OBTAINED FROM 2-CHLORO-3-AMINO-6-METHYLPHENOL, AND HAIR DYEING METHOD STARTING FROM THESE DYES AND PRECURSORS L'OREAL S.A (FR) 2011-02-24 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-20110041261-A1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF THESE DYES OBTAINED FROM 2-CHLORO-3-AMINO-6-METHYLPHENOL, AND HAIR DYEING METHOD STARTING FROM THESE DYES AND PRECURSORS KRT18, MKI67, DNMT1 PABPC1 3272/4885EGFR 1351/4885ERBB2 704/4885

“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.