SCHEMBL19607343

SCHEMBL19607343

COc1c[n+](-c2ccc(C)cc2)ccc1-c1cc[n+](C)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 11/20 0.48
▸ BCHE P06276 8/20 0.36
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SLC22A2 O15244 1/20 0.31
▸ SLC22A1 O15245 1/20 0.31
▸ SLC22A3 O75751 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ PABPC1 P11940 1/20 0.31
▸ APOBEC3A P31941 1/20 0.31
▸ EIF4H Q15056 1/20 0.31
▸ APOBEC3G Q9HC16 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
SCHEMBL19601115 0.92 ACHE (0.51) ACHEBCHEALDH1A1HPGD
SCHEMBL19601118 0.87 ACHE (0.47) ACHEBCHE
SCHEMBL19607338 0.81 ACHE (0.39) ACHEBCHEALDH1A1HPGDSLC22A2
SCHEMBL19601122 0.80 HTT (0.50) ACHESLC6A4
SCHEMBL19607291 0.80 ACHE (0.51) ACHEBCHE
SCHEMBL19601106 0.78 ACHE (0.51) ACHEBCHE
SCHEMBL19601114 0.77 ACHE (0.41) ACHEBCHEALDH1A1HPGD
SCHEMBL19601116 0.75 ACHE (0.58) ACHEBCHEALDH1A1HPGD
SCHEMBL17384312 0.75 SLC22A2 (0.48) ACHEBCHESLC22A2SLC22A1SLC22A3
SCHEMBL19601087 0.73 ACHE (0.44) ACHEBCHEALDH1A1

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-10310350-B2 Organic compound, electrochromic compound, and electrochromic element, optical filter, lens unit, imaging device, and window component having same CANON KABUSHIKI KAISHA (JP) 2019-06-04 — — US disclosed
US-20170329195-A1 ORGANIC COMPOUND, ELECTROCHROMIC COMPOUND, AND ELECTROCHROMIC ELEMENT, OPTICAL FILTER, LENS UNIT, IMAGING DEVICE, AND WINDOW COMPONENT HAVING SAME CANON KABUSHIKI KAISHA (JP) 2017-11-16 — — 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 (2 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-10310350-B2 Organic compound, electrochromic compound, and electrochromic element, optical filter, lens unit, imaging device, and window component having same KCNJ2, KCNH3, KCNN2 ACHE 416/4885BCHE 2668/4885ALDH1A1 2072/4885
US-20170329195-A1 ORGANIC COMPOUND, ELECTROCHROMIC COMPOUND, AND ELECTROCHROMIC ELEMENT, OPTICAL FILTER, LENS UNIT, IMAGING DEVICE, AND WINDOW COMPONENT HAVING SAME KCNJ2, KCNH3, KCNN2 ACHE 416/4885BCHE 2668/4885ALDH1A1 2072/4885

“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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