SCHEMBL16330388

SCHEMBL16330388

CCCCNc1ccc(/N=C2\C=C(C)C(=O)C(Cl)=C2N)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ APAF1 O14727 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ ABL1 P00519 1/20 0.32
▸ LMNA P02545 2/20 0.31
▸ SCN5A Q14524 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ DRD4 P21917 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ HRH2 P25021 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ HTR2C P28335 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ NTSR1 P30989 1/20 0.31
▸ HRH1 P35367 1/20 0.31
▸ DRD3 P35462 1/20 0.31

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
SCHEMBL1154848 0.88 — —
SCHEMBL12052177 0.88 — —
SCHEMBL1154846 0.88 — —
SCHEMBL12997208 0.85 MAPT (0.34) APAF1ALDH1A1LMNAMAPK1RAB9A
SCHEMBL12997217 0.81 — —
SCHEMBL1154492 0.81 CA12 (0.40) CA1CA2CA9ADRA2B
SCHEMBL1154494 0.81 CA12 (0.40) CA1CA2CA9ADRA2B
SCHEMBL12052168 0.80 MEN1 (0.31) APAF1MAPK1RAB9A
SCHEMBL1154231 0.80 MEN1 (0.31) APAF1MAPK1RAB9A
SCHEMBL1154228 0.80 MEN1 (0.31) APAF1MAPK1RAB9A

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 CA1 883/4885CA2 737/4885CA9 739/4885

“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.

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