SCHEMBL19601091

SCHEMBL19601091

CC[n+]1ccc(-c2cc[n+](Cc3ccccc3)cc2)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ CHKA P35790 11/20 0.46
▸ LMNA P02545 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ ACHE P22303 1/20 0.39

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
SCHEMBL19601104 0.94 ALDH1A1 (0.58) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL19601095 0.84 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL19601077 0.83 CHRNA7 (0.37) ALDH1A1KDM4ERAB9ALMNAHTT
SCHEMBL17933669 0.81 ALDH1A1 (0.68) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL19601121 0.81 ALDH1A1 (0.48) ALDH1A1KDM4ERAB9ACHKALMNA
Hydrochloric Acid SCHEMBL2463394 0.80 ALDH1A1 (0.71) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL21202118 0.80 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL21202131 0.80 ACHE (0.47) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL19601103 0.78 KDM4A (0.43) ALDH1A1KDM4ERAB9ACHKAACHE
SCHEMBL21202108 0.77 ALDH1A1 (0.48) ALDH1A1KDM4ERAB9ACHKALMNA

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 3 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
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 ALDH1A1 2072/4885KDM4E 2805/4885RAB9A 2741/4885
US-20170329195-A1 ORGANIC COMPOUND, ELECTROCHROMIC COMPOUND, AND ELECTROCHROMIC ELEMENT, OPTICAL FILTER, LENS UNIT, IMAGING DEVICE, AND WINDOW COMPONENT HAVING SAME KCNJ2, KCNH3, KCNN2 ALDH1A1 2072/4885KDM4E 2805/4885RAB9A 2741/4885

“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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