SCHEMBL19601127

SCHEMBL19601127

COc1c[n+](Cc2ccc(C)cc2)ccc1-c1cc[n+](Cc2ccc(C)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ CHKA P35790 2/20 0.46
▸ ACHE P22303 5/20 0.44
▸ BCHE P06276 1/20 0.36

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
SCHEMBL19607398 0.88 CHKA (0.38) KDM4EALDH1A1RAB9ACHKAACHE
SCHEMBL19601123 0.87 ACHE (0.45) ACHEBCHE
SCHEMBL19601124 0.87 ALDH1A1 (0.50) KDM4EALDH1A1RAB9ACHKAACHE
SCHEMBL19601130 0.83 CHKA (0.44) ALDH1A1CHKAACHE
SCHEMBL19601129 0.81 ACHE (0.39) RAB9AACHE
SCHEMBL19607399 0.81 ACHE (0.48) ALDH1A1ACHE
SCHEMBL19601121 0.81 ALDH1A1 (0.48) KDM4EALDH1A1RAB9ACHKAACHE
SCHEMBL18775289 0.76 RAB9A (0.60) KDM4EALDH1A1RAB9ACHKAACHE
SCHEMBL19601100 0.76 ACHE (0.34) KDM4ERAB9AACHE
SCHEMBL19601125 0.75 ALDH1A1 (0.44) KDM4EALDH1A1RAB9ACHKAACHE

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 KDM4E 2805/4885ALDH1A1 2072/4885RAB9A 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 KDM4E 2805/4885ALDH1A1 2072/4885RAB9A 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.

Send feedback