SCHEMBL17189697

SCHEMBL17189697

Cc1ccc2c(sc3c(F)c(C4CCC(C)CC4)ccc32)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.31
ESR2 Q92731 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
SCHEMBL17192336 1.00 CHRNA7 (0.31) CHRNA7ESR2
SCHEMBL20412671 0.88 FEN1 (0.33) CHRNA7
SCHEMBL20614189 0.87 CHRNA7 (0.32) CHRNA7ESR2
SCHEMBL20842565 0.84 SLC6A4 (0.33) CHRNA7
SCHEMBL17189700 0.82
SCHEMBL20614161 0.82 NOTUM (0.32) CHRNA7
SCHEMBL802760 0.81 ESR2 (0.37) ESR2
SCHEMBL31026 0.81 ESR2 (0.37) ESR2
SCHEMBL17189698 0.80
SCHEMBL20614170 0.79 HCRTR1 (0.31)

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
EP-3628721-B1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-03-01 EP disclosed
US-11370969-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2022-06-28 US disclosed
EP-3628721-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2020-04-01 EP disclosed
WO-2019115485-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-06-20 WO disclosed
WO-2019110636-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-06-13 WO disclosed
EP-3284803-B1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2019-01-23 EP disclosed
US-20180171231-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-06-21 US disclosed
EP-3284803-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2018-02-21 EP disclosed
US-20180044591-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2018-02-15 US disclosed
US-20180002604-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-01-04 US disclosed
US-20170362506-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-12-21 US disclosed
US-20170306232-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-10-26 US disclosed
EP-3235894-A2 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2017-10-25 EP disclosed
US-9512102-B2 4,6-difluorodibenzothiophene derivatives MERCK PATENT GMBH (DE) 2016-12-06 US disclosed
US-20160208170-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-07-21 US disclosed
US-20150299161-A1 4,6-DIFLUORODIBENZOTHIOPHENE DERIVATIVES MERCK PATENT GMBH (DE) 2015-10-22 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 (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-20150299161-A1 4,6-DIFLUORODIBENZOTHIOPHENE DERIVATIVES DDT, CD2, CYP4F2 CHRNA7 4010/4885ESR2 888/4885
US-20160208170-A1 LIQUID-CRYSTALLINE MEDIUM NEFM, VIM, PLG CHRNA7 3935/4885ESR2 3705/4885

“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.