SCHEMBL19607346

SCHEMBL19607346

Cc1c[n+](C)ccc1-c1cc[n+](C)cc1C

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHAT P28329 2/20 0.44
HDAC8 Q9BY41 8/20 0.38
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
SLC22A3 O75751 1/20 0.35
SLC6A4 P31645 1/20 0.35
ACHE P22303 2/20 0.34
BCHE P06276 1/20 0.34

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
SCHEMBL1582494 0.91 CHAT (0.39) CHATHDAC8SLC22A2SLC22A1SLC22A3
SCHEMBL10001703 0.89 CHAT (0.46) CHATHDAC8SLC22A2SLC22A1SLC22A3
SCHEMBL19607333 0.85 SLC6A4 (0.44) CHATHDAC8SLC22A2SLC22A1SLC22A3
SCHEMBL19607345 0.82 CCNC (0.39) CHAT
SCHEMBL5297606 0.80
Iodide SCHEMBL3857270 0.78 CHAT (0.44) CHATHDAC8ACHEBCHE
Water SCHEMBL10815229 0.78 CHAT (0.44) CHATHDAC8SLC22A2SLC22A1SLC22A3
SCHEMBL14419209 0.75 CHAT (0.43) CHATHDAC8ACHEBCHE
SCHEMBL10915943 0.74
SCHEMBL21202117 0.73 GRM4 (0.40)

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 CHAT 1282/4885HDAC8 2560/4885SLC22A2 693/4885
US-20170329195-A1 ORGANIC COMPOUND, ELECTROCHROMIC COMPOUND, AND ELECTROCHROMIC ELEMENT, OPTICAL FILTER, LENS UNIT, IMAGING DEVICE, AND WINDOW COMPONENT HAVING SAME KCNJ2, KCNH3, KCNN2 CHAT 1282/4885HDAC8 2560/4885SLC22A2 693/4885

“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.