SCHEMBL30150

SCHEMBL30150

CC1CCC(c2ccc(C#N)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.57
GRIA1 P42261 1/20 0.47
GRIA2 P42262 1/20 0.47
GRIA3 P42263 1/20 0.47
HRH3 Q9Y5N1 3/20 0.47
KCNH2 Q12809 1/20 0.47
ALDH1A1 P00352 3/20 0.41
CYP2A6 P11509 2/20 0.41
HSD11B1 P28845 1/20 0.41
EGLN2 Q96KS0 1/20 0.40
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
USP30 Q70CQ3 4/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL20083485 1.00 ESR2 (0.57) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL16488063 1.00 ESR2 (0.57) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL11524397 0.94 HRH3 (0.54) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL14649680 0.94 HRH3 (0.54) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL10766113 0.94 ESR2 (0.52) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL10909714 0.94 ESR2 (0.52) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL11524401 0.94 HRH3 (0.54) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL14649679 0.90 HRH3 (0.50) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL12754493 0.90 ESR2 (0.47) ESR2GRIA1GRIA2GRIA3HRH3
SCHEMBL18499515 0.90 ESR2 (0.47) ESR2GRIA1GRIA2GRIA3HRH3

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 359 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
US-20230399567-A1 Liquid Crystal Element and Emulsion Composition MITSUBISHI CHEMICAL CORPORATION (JP) 2023-12-14 US disclosed
EP-3810724-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-11-22 EP disclosed
US-11788009-B2 Liquid-crystalline medium for use in a switching element MERCK PATENT GMBH (DE) 2023-10-17 US disclosed
US-11788009-B2 Liquid-crystalline medium for use in a switching element MERCK PATENT GMBH (DE) 2023-10-17 US disclosed
US-11762241-B2 Device for the regulation of light transmission MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-11762241-B2 Device for the regulation of light transmission MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-11760931-B2 Liquid-crystalline medium for use in a switching element MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-11760931-B2 Liquid-crystalline medium for use in a switching element MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-7314653-B2 Liquid-crystal medium and electro-optical display containing same MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-01-01 US disclosed
US-7297377-B2 Liquid crystal display devices HITACHI, LTD. (JP) 2007-11-20 US disclosed
EP-1813980-A1 LIQUID CRYSTAL DISPLAY DEVICE AND ELECTRONIC DEVICE HAVING THE SAME Sharp Kabushiki Kaisha (JP) 2007-08-01 EP disclosed
EP-1801186-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2007-06-27 EP disclosed
EP-1577286-B1 PERFLUOROALLYLOXY COMPOUND AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE COMPOUND ADEKA CORP (JP) 2007-06-13 EP disclosed
US-20040155222-A1 Liquid crystal display devices IPS ALPHA SUPPORT CO., LTD. (JP) 2004-08-12 US disclosed
US-20020186340-A1 Liquid crystal display devices KAGAWA HIROYUKI (JP) 2002-12-12 US disclosed
US-6423385-B1 Liquid crystal display devices HITACHI, LTD. (JP) 2002-07-23 US disclosed
EP-1033606-A2 Liquid crystal display device Hitachi, Ltd. (JP) 2000-09-06 EP disclosed
US-4130502-A Liquid crystalline cyclohexane derivatives MERCK PATENT GESELLSCHAFT MIT (DE) 1978-12-19 US disclosed