SCHEMBL1974146

SCHEMBL1974146

Nc1ccc(CCOC(=O)C=Cc2ccc(OC(=O)c3ccc(OCCCC(F)(F)F)cc3)cc2)c(N)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA4 P22748 3/20 0.41
CA6 P23280 3/20 0.41
CA5A P35218 3/20 0.41
CA7 P43166 3/20 0.41
CA9 Q16790 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA5B Q9Y2D0 3/20 0.41
MET P08581 7/20 0.38
ABCG2 Q9UNQ0 2/20 0.37
ALOX5 P09917 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
CYP1A1 P04798 1/20 0.37
CYP1B1 Q16678 1/20 0.37
AKR1B10 O60218 2/20 0.36
AKR1B1 P15121 2/20 0.36
MAOB P27338 1/20 0.36
PPARA Q07869 1/20 0.35

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
SCHEMBL679824 1.00 CA12 (0.41) CA12CA1CA4CA6CA5A
SCHEMBL13720132 1.00 CA12 (0.41) CA12CA1CA4CA6CA5A
SCHEMBL1564685 1.00 CA12 (0.41) CA12CA1CA4CA6CA5A
Ammonia Solution, Strong SCHEMBL15991542 0.99 CA12 (0.40) CA12CA1CA4CA6CA5A
SCHEMBL5069201 0.97 CA12 (0.40) CA12CA1CA4CA6CA5A
SCHEMBL1564021 0.97 CA12 (0.40) CA12CA1CA4CA6CA5A
SCHEMBL1565210 0.97 CA12 (0.40) CA12CA1CA4CA6CA5A
SCHEMBL21702567 0.96 CA12 (0.36) CA12CA1CA4CA6CA5A
SCHEMBL1565147 0.96 MET (0.39) CA12CA1CA4CA6CA5A
SCHEMBL10299065 0.95 CA12 (0.37) CA12CA1CA4CA6CA5A

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3107978-B1 LIQUID CRYSTAL ALIGNMENT COMPOSITION, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT ROLIC TECH AG (CH) 2020-05-06 EP disclosed
EP-2534191-B1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION ROLIC TECH AG (CH) 2020-04-15 EP disclosed
US-10557085-B2 Photoalignment composition ROLIC AG (CH) 2020-02-11 US disclosed
US-20180079961-A1 PHOTOALIGNMENT COMPOSITION ROLIC AG (CH) 2018-03-22 US disclosed
US-9765235-B2 Photoaligning material ROLIC AG (CH) 2017-09-19 US disclosed
US-9493394-B2 Photoaligning materials ROLIC AG (CH) 2016-11-15 US disclosed
US-9334366-B2 Photoaligning materials ROLIC AG (CH) 2016-05-10 US disclosed
US-20140342086-A1 PHOTOALIGNING MATERIALS ROLIC AG (CH) 2014-11-20 US disclosed
US-20140249244-A1 PHOTOALIGNING MATERIALS ROLIC AG (CH) 2014-09-04 US disclosed
EP-2471893-B1 Liquid crystal alignment agent, liquid crystal alignment film manufactured using the same, and liquid crystal display device including the liquid crystal alignment film CHEIL IND INC (KR) 2014-08-27 EP disclosed
US-20130162920-A1 LIQUID CRYSTAL DISPLAY PANEL, LIQUID CRYSTAL DISPLAY DEVICE, AND POLYMER FOR ALIGNMENT FILM MATERIAL SHARP KABUSHIKI KAISHA (JP) 2013-06-27 US disclosed
US-20130165598-A1 Liquid Crystal Photoalignment Agent, Liquid Crystal Photoalignment Film Using the Same, and Liquid Crystal Display Device Including the Liquid Crystal Photoalignment Film CHEIL INDUSTRIES INC. (KR) 2013-06-27 US disclosed
US-20130155362-A1 LIQUID CRYSTAL DISPLAY PANEL, LIQUID CRYSTAL DISPLAY DEVICE, AND POLYMER FOR ALIGNMENT FILM MATERIAL SHARP KABUSHIKI KAISHA (JP) 2013-06-20 US disclosed
EP-2534191-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION Rolic AG (CH) 2012-12-19 EP disclosed
US-20120316317-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION ROLIC AG (CH) 2012-12-13 US disclosed
US-20120287390-A1 Liquid Crystal Alignment Agent, Liquid Crystal Alignment Film Manufactured Using the Same, and Liquid Crystal Display Device Including the Liquid Crystal Alignment Film CHEIL INDUSTRIES INC. (KR) 2012-11-15 US disclosed
US-20120172540-A1 Liquid Crystal Alignment Agent, Liquid Crystal Alignment Film Manufactured Using the Same, and Liquid Crystal Display Device Including the Liquid Crystal Alignment Film CHEIL INDUSTRIES INC. (KR) 2012-07-05 US disclosed
EP-2471893-A2 Liquid crystal alignment agent, liquid crystal alignment film manufactured using the same, and liquid crystal display device including the liquid crystal alignment film Cheil Industries Inc. (KR) 2012-07-04 EP disclosed
WO-2011098461-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION ROLIC AG (CH) 2011-08-18 WO disclosed
US-20110144299-A1 Liquid Crystal Photo-Alignment Agent, Liquid Crystal Photo-Alignment Layer Manufactured Using the Same, and Liquid Crystal Display Device Including the Liquid Crystal Photo-Alignment Layer CHEIL INDUSTRIES INC. (KR) 2011-06-16 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-20120316317-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION LATS1, LATS2, LCP1 CA12 3886/4885CA1 4347/4885CA4 2365/4885
US-20140249244-A1 PHOTOALIGNING MATERIALS LCP1, PIN1, MAP1LC3C CA12 3298/4885CA1 3416/4885CA4 3494/4885

“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.