SCHEMBL18411549

SCHEMBL18411549

COc1cc(-c2cc(OCCO)cc(OCCO)c2)ccc1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.50
▸ MAPT P10636 3/20 0.50
▸ NPC1 O15118 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ USP2 O75604 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ ERN1 O75460 2/20 0.49
▸ ABCB1 P08183 2/20 0.48
▸ MAPK1 P28482 1/20 0.47
▸ APP P05067 1/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ ADRA1D P25100 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ ADRA1B P35368 1/20 0.46
▸ CTSV O60911 1/20 0.46

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
SCHEMBL12303132 0.82 KDM4E (0.60) TSHRMAPTNPC1RAB9AKDM4E
SCHEMBL18311417 0.80 MCHR1 (0.47) MAPTALDH1A1HPGDLMNAERN1
SCHEMBL21003759 0.80 NPC1 (0.56) TSHRMAPTNPC1RAB9AKDM4E
SCHEMBL8545077 0.80 TSHR (0.53) TSHRMAPTNPC1RAB9AKDM4E
SCHEMBL18625279 0.77 GSTP1 (0.57) ALDH1A1LMNAMEN1KMT2A
SCHEMBL18308832 0.76 ALOX5 (0.46) TSHRMAPTHSD17B10HPGDLMNA
SCHEMBL18308837 0.76 KMO (0.41) TSHRALDH1A1HSD17B10ERN1ABCB1
SCHEMBL8545841 0.76 MCL1 (0.56) TSHRMAPTNPC1RAB9AKDM4E
SCHEMBL18411547 0.75 GAA (0.56) MAPTKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL1322956 0.75 KDM4E (0.64) NPC1RAB9AKDM4EHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11225606-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2022-01-18 — — US disclosed
US-20200248078-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2020-08-06 — — US disclosed
EP-3121247-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2019-10-02 — — EP disclosed
US-20190256777-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2019-08-22 — — US disclosed
US-10344215-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2019-07-09 — — US disclosed
EP-3121247-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2017-01-25 — — 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 (4 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-11225606-B2 Polymerizable compounds and the use thereof in liquid-crystal displays VCL, PLEC, EML4 TSHR 4853/4885MAPT 40/4885NPC1 3628/4885
US-10344215-B2 Polymerizable compounds and the use thereof in liquid-crystal displays VCL, PLEC, EML4 TSHR 4853/4885MAPT 40/4885NPC1 3628/4885
US-20190256777-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 TSHR 4853/4885MAPT 40/4885NPC1 3628/4885
US-20200248078-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 TSHR 4853/4885MAPT 40/4885NPC1 3628/4885

“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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