SCHEMBL14225431

SCHEMBL14225431

COc1cccc(OC(C)C)c1-c1ccc(-c2ccc(-c3ccc(-c4c(OC)cccc4OC(C)C)s3)s2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.46
▸ MCHR1 Q99705 2/20 0.41
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA7 P43166 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CTSA P10619 1/20 0.37
▸ EGFR P00533 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ CSF1R P07333 1/20 0.36
▸ RET P07949 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35
▸ TOP1 P11387 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 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
SCHEMBL14225418 1.00 APP (0.46) APPMCHR1CA1CA2CA7
SCHEMBL19521918 1.00 APP (0.46) APPMCHR1CA1CA2CA7
SCHEMBL14225415 0.98 APP (0.47) APPMCHR1CA1CA2CA7
SCHEMBL14225439 0.91 APP (0.43) APPMCHR1CA1CA2CA7
SCHEMBL17431884 0.90 APP (0.38) APPMCHR1CA1CA2CA7
SCHEMBL17431908 0.87 APP (0.57) APPMCHR1CA1CA2CA7
SCHEMBL17431906 0.85 APP (0.37) APPMCHR1CA1CA2CA7
SCHEMBL17790458 0.85 APP (0.59) APPMCHR1CA1CA2CA7
SCHEMBL14225424 0.83 EGFR (0.40) APPMCHR1CA1CA2CA7
SCHEMBL14225436 0.82 CTSA (0.39) APPMCHR1CTSAEGFRAURKA

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9611233-B2 Organic compound CANON KABUSHIKI KAISHA (JP) 2017-04-04 — — US disclosed
US-9611233-B2 Organic compound CANON KABUSHIKI KAISHA (JP) 2017-04-04 — — US disclosed
EP-2797928-B1 NOVEL ORGANIC COMPOUND CANON KK (JP) 2017-03-29 — — EP disclosed
US-20160152633-A1 NOVEL ORGANIC COMPOUND CANON KK (JP) 2016-06-02 — — US disclosed
US-20160152633-A1 NOVEL ORGANIC COMPOUND CANON KK (JP) 2016-06-02 — — US disclosed
EP-2719702-B1 ELECTROCHROMIC ELEMENT CANON KK (JP) 2016-05-11 — — EP disclosed
US-9284328-B2 Organic compound CANON KABUSHIKI KAISHA (JP) 2016-03-15 — — US disclosed
US-9001408-B2 Electrochromic device CANON KABUSHIKI KAISHA (JP) 2015-04-07 — — US disclosed
US-9001408-B2 Electrochromic device CANON KABUSHIKI KAISHA (JP) 2015-04-07 — — US disclosed
US-20150031894-A1 NOVEL ORGANIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2015-01-29 — — US disclosed
US-20150031894-A1 NOVEL ORGANIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2015-01-29 — — US disclosed
EP-2719702-A1 ELECTROCHROMIC ELEMENT Canon Kabushiki Kaisha (JP) 2014-04-16 — — EP disclosed
US-20120314272-A1 ELECTROCHROMIC DEVICE CANON KABUSHIKI KAISHA (JP) 2012-12-13 — — US disclosed
US-20120314272-A1 ELECTROCHROMIC DEVICE CANON KABUSHIKI KAISHA (JP) 2012-12-13 — — 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-20150031894-A1 NOVEL ORGANIC COMPOUND AOX1, AOC2, OXER1 APP 2906/4885MCHR1 1514/4885CA1 2412/4885
US-20160152633-A1 NOVEL ORGANIC COMPOUND AOX1, AOC2, OXER1 APP 2906/4885MCHR1 1514/4885CA1 2412/4885

“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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