SCHEMBL14015490

SCHEMBL14015490

CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(Br)s3)s2)sc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.40
TYR P14679 2/20 0.40
TP53 P04637 2/20 0.40
CYP3A4 P08684 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LIPG Q9Y5X9 1/20 0.38
GPR35 Q9HC97 1/20 0.35
PTGS2 P35354 5/20 0.33
ESR1 P03372 2/20 0.33
ADRA2A P08913 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
TACR2 P21452 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33

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
SCHEMBL1492474 1.00 ALOX5 (0.40) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL14881177 1.00 ALOX5 (0.40) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL14122091 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL1419440 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL329156 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL1419425 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL1419676 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL1419514 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL2491229 0.93 ALOX5 (0.41) ALOX5TYRTP53CYP3A4MEN1
SCHEMBL15089945 0.91 TYR (0.35) ALOX5TYRTP53CYP3A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9977306-B2 Electrochromic device, optical filter, lens unit, and imaging apparatus CANON KABUSHIKI KAISHA (JP) 2018-05-22 US disclosed
US-9611233-B2 Organic compound CANON KABUSHIKI KAISHA (JP) 2017-04-04 US disclosed
US-20160299401-A1 ELECTROCHROMIC DEVICE, OPTICAL FILTER, LENS UNIT, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-10-13 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-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-20080262183-A1 Dithienopyrrole-containing copolymers HONEYWELL INTERNATIONAL INC 2008-10-23 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 ALOX5 1094/4885TYR 23/4885TP53 4342/4885
US-20160152633-A1 NOVEL ORGANIC COMPOUND AOX1, AOC2, OXER1 ALOX5 1094/4885TYR 23/4885TP53 4342/4885

“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.