SCHEMBL15725322

SCHEMBL15725322

Cc1ccc(COC2CCC(C3CCC(C)CC3)CC2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.35
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
EPHX2 P34913 1/20 0.30

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
SCHEMBL15725321 0.96 HTR1A (0.37) HTR1ACARM1PRMT6EPHX2
SCHEMBL26036150 0.88 HTR1A (0.41) HTR1ACARM1PRMT6
SCHEMBL15725323 0.88 HTR1A (0.33) HTR1ACARM1PRMT6
SCHEMBL15725325 0.88 HTR1A (0.33) HTR1ACARM1PRMT6
SCHEMBL18077324 0.87 HTR1A (0.34) HTR1ACARM1PRMT6
SCHEMBL4549774 0.84 NAAA (0.37) HTR1ACARM1PRMT6
SCHEMBL15725326 0.83 HTR1A (0.35) HTR1ACARM1PRMT6EPHX2
SCHEMBL15725324 0.83 HTR1A (0.35) HTR1ACARM1PRMT6EPHX2
SCHEMBL15727932 0.82 HTR1A (0.36) HTR1ACARM1PRMT6EPHX2
SCHEMBL10302569 0.80 HTR1A (0.38) HTR1ACARM1PRMT6EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180171231-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-06-21 US disclosed
US-9951274-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2018-04-24 US disclosed
US-20180030350-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-02-01 US disclosed
US-9580653-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-02-28 US disclosed
US-20170044438-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-02-16 US disclosed
US-20170044437-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-02-16 US disclosed
US-20170037316-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-02-09 US disclosed
US-20160319194-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-11-03 US disclosed
US-9234136-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2016-01-12 US disclosed
US-20150322342-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-11-12 US disclosed
US-20150175884-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-06-25 US disclosed
US-20140138581-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-05-22 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 (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-20170044438-A1 LIQUID-CRYSTALLINE MEDIUM VIM, COL2A1, COL1A1 HTR1A 463/4885CARM1 384/4885PRMT6 2938/4885
US-20170037316-A1 LIQUID-CRYSTALLINE MEDIUM FES, NEFM, SOST HTR1A 530/4885CARM1 3050/4885PRMT6 4275/4885
US-20180030350-A1 LIQUID-CRYSTALLINE MEDIUM VIM, COL2A1, COL1A1 HTR1A 463/4885CARM1 384/4885PRMT6 2938/4885
US-20170044437-A1 LIQUID-CRYSTALLINE MEDIUM VIM, COL2A1, COL1A1 HTR1A 463/4885CARM1 384/4885PRMT6 2938/4885

“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.