SCHEMBL6599481

SCHEMBL6599481

Fc1c(Cl)cc(CBr)cc1Cl

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
IDO1 P14902 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
CYP3A4 P08684 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
SCHEMBL21358255 0.84 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL17062073 0.78 IDO1 (0.33) IDO1CYP3A4
SCHEMBL15517004 0.74 IDO1 (0.31) IDO1CYP3A4
SCHEMBL22085844 0.74 CYP4F2 (0.38) TRPA1ALDH1A1TSHRIDO1CYP4F2
SCHEMBL25219828 0.74 TRPA1 (0.32) TRPA1ALDH1A1TSHR
SCHEMBL23588139 0.74 ACHE (0.42) TSHRIDO1CYP4F2CYP4A11
SCHEMBL11590958 0.74 HSD17B10 (0.50) ALDH1A1TSHRCYP4F2CYP4A11CYP3A4
SCHEMBL17071829 0.74 HTR2A (0.36) TRPA1ALDH1A1IDO1
SCHEMBL29354626 0.73 PIK3CA (0.44) TRPA1ALDH1A1TSHRIDO1CYP4F2
SCHEMBL118390 0.73 PIK3CA (0.44) TRPA1ALDH1A1TSHRIDO1CYP4F2

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-20040152903-A1 6-chloro-3-pyridylmethylpropylamine derivatives, preparation process thereof and bactericides KUREHA CORPORATION (JP) 2004-08-05 US disclosed
EP-1375483-A1 6-CHLORO-3-PYRIDYLMETHYLPROPYLAMINE DERIVATIVES, PREPARATION PROCESS THEREOF AND BACTERICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2004-01-02 EP 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-20040152903-A1 6-chloro-3-pyridylmethylpropylamine derivatives, preparation process thereof and bactericides PGLS, TLR6, UROD TRPA1 1023/4885ALDH1A1 2464/4885TSHR 3142/4885

“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.