SCHEMBL168299

SCHEMBL168299

COc1ccc(F)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
MAPK14 Q16539 1/20 0.44
GAA P10253 1/20 0.44
ACHE P22303 2/20 0.44
CYP1A2 P05177 2/20 0.43
CYP2A6 P11509 1/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1B1 Q16678 1/20 0.43
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
HTR3A P46098 1/20 0.42
HTR3D Q70Z44 1/20 0.42
HTR3C Q8WXA8 1/20 0.42
NFE2L2 Q16236 1/20 0.42

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
SCHEMBL29555340 1.00 RAB9A (0.46) RAB9ACA12CA1CA2CA7
SCHEMBL11692690 0.83 DYRK1A (0.50) RAB9ACA12CA1CA2CA7
SCHEMBL171839 0.81 CYP1A2 (0.47) RAB9ACA12CA1CA2CA7
SCHEMBL29513208 0.80 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL254529 0.80 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL1047284 0.79 HTR2A (0.41) RAB9AMAPK14ACHEHTR2ASLC6A4
SCHEMBL12094745 0.79 HTR2A (0.41) RAB9AMAPK14ACHEHTR2ASLC6A4
Ammonia Solution, Strong SCHEMBL27831764 0.79 CYP1A2 (0.46) RAB9ACA12CA1CA2CA7
SCHEMBL13246009 0.77 KMT2A (0.47) RAB9AHTR2ASLC6A4KCNH2
SCHEMBL177568 0.77 HTR2A (0.40) RAB9AMAPK14ACHEHTR2ASLC6A4

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 1063 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3692101-B1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES ALFA INSTR S R L (IT) 2022-01-12 EP claimed
EP-3692101-A1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES Alfa Instruments S.r.l. (IT) 2020-08-12 EP claimed
WO-2019068935-A1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES ALFA INSTRUMENTS S.R.L. (IT) 2019-04-11 WO claimed
EP-1891180-B1 ORGANIC SEMICONDUCTOR SOLUTIONS MERCK PATENT GMBH (DE) 2018-08-29 EP claimed
EP-1716604-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-07-26 EP claimed
US-20160329510-A1 PHOTOVOLTAIC CELLS MERCK PATENT GMBH (DE) 2016-11-10 US claimed
EP-3087156-A1 PHOTOVOLTAIC CELLS Merck Patent GmbH (DE) 2016-11-02 EP claimed
CN-105849931-A Photovoltaic cell 默克专利有限公司 2016-08-10 CN claimed
EP-1745520-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-10-21 EP claimed
WO-2015096886-A1 PHOTOVOLTAIC CELLS MERCK PATENT GMBH (DE) 2015-07-02 WO claimed
CN-1922744-A Solutions of organic semiconductors MERCK PATENT GMBH (DE) 2007-02-28 CN claimed
EP-1745520-A1 SOLUTIONS OF ORGANIC SEMICONDUCTORS Merck Patent GmbH (DE) 2007-01-24 EP claimed
WO-2006122732-A1 ORGANIC SEMICONDUCTOR SOLUTIONS MERCK PATENT GMBH (DE) 2006-11-23 WO claimed
EP-1716604-A1 SOLUTIONS OF ORGANIC SEMICONDUCTORS Merck Patent GmbH (DE) 2006-11-02 EP claimed
EP-1370619-B1 SOLUTIONS AND DISPERSIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2006-06-21 EP claimed
US-20060127592-A1 Solutions and dispersions of organic semiconductors COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-06-15 US claimed
US-6994893-B2 Dispersions of organic semiconductors in a solvent mixture of at least two different organic solvents, characterized in that each of the solvents on its own has a boiling point of below 200 degrees C. and a melting point of 15 degrees C. or less COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-02-07 US claimed
WO-2005112145-A1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2005-11-24 WO claimed
WO-2005083814-A1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2005-09-09 WO claimed
US-20040225056-A1 Solutions and dispersions of organic semiconductors MERCK PATENT GMBH (DE) 2004-11-11 US claimed