SCHEMBL18509998

SCHEMBL18509998

C=CC1CCC(COc2ccc(OCC3CCCCC3)c(F)c2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.39
HTR6 P50406 1/20 0.39
MCHR1 Q99705 2/20 0.37
PARP10 Q53GL7 4/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
HPGD P15428 3/20 0.36
PARP15 Q460N3 3/20 0.36
FFAR1 O14842 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
SCHEMBL12366406 0.94 HTR2C (0.40) HTR2AHTR2CHTR2B
SCHEMBL24170300 0.90 HTR2C (0.37) HTR2AHTR2CHTR2B
SCHEMBL12366417 0.90 HTR2C (0.37) HTR2AHTR2CHTR2B
SCHEMBL1512804 0.88 HTR2C (0.42) SLC6A4HTR6HTR2AHTR2CHTR2B
SCHEMBL26036401 0.88 HTR2C (0.36) HTR2AHTR2CHTR2B
SCHEMBL1512802 0.88 HTR2C (0.42) SLC6A4HTR6HTR2AHTR2CHTR2B
SCHEMBL1853162 0.88 HTR2C (0.36) HTR2AHTR2CHTR2B
SCHEMBL1853160 0.88 HTR2C (0.36) HTR2AHTR2CHTR2B
SCHEMBL15727962 0.87 HPGD (0.39) HTR2AHTR2CHTR2BHPGD
SCHEMBL2266958 0.87 HTR2C (0.36) HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873438-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-01-16 US disclosed
US-11739266-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-08-29 US disclosed
US-20230007940-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCKP PATENT GMBH (DE) 2023-01-12 US disclosed
US-20230002678-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2023-01-05 US disclosed
US-11214736-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2022-01-04 US disclosed
US-20210222067-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2021-07-22 US disclosed
US-10934487-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2021-03-02 US disclosed
US-10894918-B2 Liquid crystal medium containing polymerisable compounds MERCK PATENT GMBH (DE) 2021-01-19 US disclosed
US-10759996-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2020-09-01 US disclosed
US-20190345389-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-11-14 US disclosed
US-20190316037-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-10-17 US disclosed
US-10400169-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2019-09-03 US disclosed
US-20190264105-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2019-08-29 US disclosed
US-20180171231-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-06-21 US disclosed
US-9944416-B2 Filling device and use thereof for dispensing a fluid MERCK PATENT GMBH (DE) 2018-04-17 US disclosed
US-20170044438-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-02-16 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-20170044438-A1 LIQUID-CRYSTALLINE MEDIUM VIM, COL2A1, COL1A1 SLC6A4 3961/4885HTR6 1887/4885MCHR1 4265/4885
US-10400169-B2 Liquid-crystalline medium VIM, COL2A1, COL1A1 SLC6A4 3961/4885HTR6 1887/4885MCHR1 4265/4885

“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.