SCHEMBL172023

SCHEMBL172023

CC(C)(C)c1cc(CCC(=O)OCC(COC=O)(COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.49
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.43
ALDH1A1 P00352 4/20 0.43
TSHR P16473 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
MAPK1 P28482 2/20 0.43
BLM P54132 2/20 0.43
ATM Q13315 2/20 0.43
HIF1A Q16665 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
USP2 O75604 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 2/20 0.38
PKM P14618 1/20 0.38
LMNA P02545 3/20 0.38
AGTR1 P30556 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL10036413 1.00 GAA (0.49) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL20662719 0.94 GAA (0.44) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL9613609 0.94 GAA (0.46) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL30209 0.91 GAA (0.57) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL10297359 0.90 GAA (0.41) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL12807224 0.90 GAA (0.41) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL12031561 0.90 GAA (0.41) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL12439523 0.89 GAA (0.40) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL29923229 0.89 GAA (0.56) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL29764272 0.89 GAA (0.56) GAAKMT2AMEN1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024128240-A1 RESIN COMPOSITION 三菱瓦斯化学株式会社 2024-06-20 WO disclosed
EP-3688118-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2021-05-19 EP disclosed
EP-3757192-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2020-12-30 EP disclosed
US-20120327357-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL MEDIA AND LIQUID-CRYSTAL DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-12-27 US disclosed
EP-2514800-A2 Compounds and liquid crystalline medium Merck Patent GmbH (DE) 2012-10-24 EP disclosed
EP-2222816-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-10-17 EP disclosed
US-20120248374-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-10-04 US disclosed
WO-2012130380-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-10-04 WO disclosed
EP-2176376-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-09-19 EP disclosed
EP-2265691-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-08-29 EP disclosed
EP-1959000-A1 Liquid crystalline medium MERCK PATENT GmbH (DE) 2008-08-20 EP disclosed
EP-1956069-A1 Liquid crystalline medium Merck Patent GmbH (DE) 2008-08-13 EP disclosed
EP-1935963-A1 Liquid-crystalline medium Merck Patent GmbH (DE) 2008-06-25 EP disclosed
US-20080121843-A1 Liquid crystals having a terminal polar radical and a terminal CH3 group and simultaneously having very high specific resistances and low threshold voltages requiring a high clearing point and low rotational viscosity; matrices HECKMEIER MICHAEL 2008-05-29 US disclosed
US-7371437-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2008-05-13 US disclosed
US-7361288-B2 Components for high-frequency technology MERCK PATENT GESELLSCHAFT MIT BESSCHRANKTER HAFTUNG (DE) 2008-04-22 US disclosed
EP-1746079-B1 Fluorinated biphenyl compounds for use in liquid crystal compositions MERCK PATENT GMBH (DE) 2008-03-26 EP disclosed
WO-2008009417-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2008-01-24 WO disclosed
WO-2008009398-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2008-01-24 WO disclosed
EP-1876214-A2 Liquid crystalline medium Merck Patent GmbH (DE) 2008-01-09 EP 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-20120248374-A1 LIQUID CRYSTALLINE MEDIUM LBR, CTNND1, VIM GAA 3873/4885KMT2A 4403/4885MEN1 663/4885
US-20120327357-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL MEDIA AND LIQUID-CRYSTAL DISPLAYS LPXN, VCL, MAP1LC3C GAA 3851/4885KMT2A 3584/4885MEN1 1184/4885

“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.