SCHEMBL21386545

SCHEMBL21386545

Cc1ccc2c(c1F)OCc1c-2ccc(-c2ccc3c(c2F)COc2c-3ccc(C)c2F)c1F

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
PGR P06401 10/20 0.39
AR P10275 5/20 0.33
NR3C1 P04150 4/20 0.33

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
SCHEMBL170550 0.95 ESR1 (0.46) ESR1ESR2PGRARNR3C1
SCHEMBL12990387 0.88 ESR1 (0.39) ESR1ESR2PGRARNR3C1
SCHEMBL21115679 0.85 ESR1 (0.40) ESR1ESR2PGRARNR3C1
SCHEMBL12990799 0.84 ESR1 (0.39) ESR1ESR2PGRARNR3C1
SCHEMBL15180355 0.79 ESR1 (0.35) ESR1ESR2PGR
SCHEMBL17997301 0.75 S1PR5 (0.34) ESR1ESR2PGR
SCHEMBL22137718 0.74 ESR1 (0.32) ESR1ESR2
SCHEMBL14277901 0.73 APP (0.36)
SCHEMBL783930 0.73 ESR1 (0.54) ESR1ESR2PGRARNR3C1
SCHEMBL803200 0.72 ESR1 (0.62) ESR1ESR2PGRARNR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3739020-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
EP-3933009-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-08-16 EP disclosed
EP-3839008-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-07-26 EP disclosed
WO-2022129018-A1 HETEROAROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2022-06-23 WO disclosed
WO-2022128845-A1 HETEROAROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2022-06-23 WO disclosed
WO-2022106387-A1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2022-05-27 WO disclosed
WO-2022090099-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2022-05-05 WO disclosed
WO-2022043376-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2022-03-03 WO disclosed
WO-2022008474-A1 OPTICAL COMPONENT MERCK PATENT GMBH (DE) 2022-01-13 WO disclosed
WO-2022003001-A1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2022-01-06 WO disclosed
EP-3839008-A1 LIQUID CRYSTAL MEDIUM Merck Patent GmbH (DE) 2021-06-23 EP disclosed
WO-2021116080-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2021-06-17 WO disclosed
WO-2021069535-A1 FLUORINATED AROMATIC COMPOUNDS MERCK PATENT GMBH (DE) 2021-04-15 WO disclosed
WO-2021037962-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2021-03-04 WO disclosed
EP-3733816-A1 ISOTHIOCYANATO-TOLANES Merck Patent GmbH (DE) 2020-11-04 EP disclosed
EP-3543313-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-10-07 EP disclosed
EP-3543314-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-09-09 EP disclosed
WO-2020120586-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2020-06-18 WO disclosed
EP-3543313-A1 LIQUID-CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-09-25 EP disclosed
EP-3543314-A1 LIQUID-CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-09-25 EP disclosed