SCHEMBL4427660

SCHEMBL4427660

CC1CCC(c2ccc(-c3ccc(F)c(F)c3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.50
KDM1A O60341 2/20 0.37
CYP17A1 P05093 2/20 0.37
CYP11B2 P19099 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP11B1 P15538 1/20 0.37
P2RY14 Q15391 1/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2C9 P11712 2/20 0.35
APP P05067 2/20 0.35
PGR P06401 4/20 0.34
MAOA P21397 1/20 0.34
KDM4E B2RXH2 1/20 0.34
FASN P49327 1/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 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
SCHEMBL14064159 0.95 ESR2 (0.46) ESR2KDM1ACYP17A1CYP11B2NPC1
SCHEMBL2741559 0.92 ESR2 (0.44) ESR2KDM1ACYP17A1CYP11B2NPC1
SCHEMBL16280876 0.92 ESR2 (0.44) ESR2KDM1ACYP17A1CYP11B2NPC1
SCHEMBL18137079 0.87 ESR2 (0.41) ESR2CYP17A1CYP11B2NPC1RAB9A
SCHEMBL4434479 0.87 ESR2 (0.47) ESR2NPC1RAB9ACYP3A4CYP2C9
SCHEMBL22329052 0.87 ESR2 (0.47) ESR2NPC1RAB9ACYP3A4CYP2C9
SCHEMBL20083067 0.87 ESR2 (0.47) ESR2KDM1ACYP17A1CYP11B2NPC1
SCHEMBL21417715 0.87 ESR2 (0.47) ESR2KDM1ACYP17A1CYP11B2NPC1
SCHEMBL12579697 0.87 ESR2 (0.47) ESR2KDM1ACYP17A1CYP11B2NPC1
SCHEMBL4434770 0.86 ESR2 (0.50) ESR2NPC1RAB9AP2RY14CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043782-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2024-07-23 US disclosed
US-12043782-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2024-07-23 US disclosed
WO-2024017812-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2024-01-25 WO disclosed
EP-4279565-A2 THIOPHENE COMPOUND, LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2023-11-22 EP disclosed
EP-3980510-B1 LIQUID CRYSTAL MIXTURE AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2023-11-08 EP disclosed
EP-3679111-B1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2023-11-01 EP disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
EP-4261267-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2023-10-18 EP disclosed
US-11788009-B2 Liquid-crystalline medium for use in a switching element MERCK PATENT GMBH (DE) 2023-10-17 US disclosed
US-7291367-B2 Liquid-crystalline compounds MERCK PATENT GMBH (DE) 2007-11-06 US disclosed
US-20070237907-A1 PHOTOSTABLE LIQUID-CRYSTALLINE MEDIUM MANABE ATSUTAKA 2007-10-11 US disclosed
US-7270856-B2 Cyclobutane derivatives MERCK PATENT GMBH (DE) 2007-09-18 US disclosed
US-20070176144-A1 Liquid crystal composition for bistable liquid crystal devices MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2007-08-02 US disclosed
US-7250198-B2 For electrooptical display MERCK PATENT GMBH (DE) 2007-07-31 US disclosed
US-20070104895-A1 LIQUID CRYSTAL OPTICAL MODULATION ELEMENT AND OPTICAL HEAD DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-7211302-B2 Photostable liquid crystalline medium MERCK PATENT GMBH (DE) 2007-05-01 US disclosed
US-7189440-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2007-03-13 US disclosed
US-7175891-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2007-02-13 US disclosed
US-20070001149-A1 Liquid-crystal medium containing monofluoroterphenyl compounds MERCK PATENT GMBH (DE) 2007-01-04 US disclosed