SCHEMBL4938362

SCHEMBL4938362

FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)c1cc([B-](c2cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c2)(c2cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c2)c2cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c2)cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1.[Na+]

nearest known ligand 0.32

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32

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
SCHEMBL4934552 0.98 LMNA (0.33) LMNA
SCHEMBL4938355 0.98 LMNA (0.33) LMNA
SCHEMBL4930840 0.98 LMNA (0.33) LMNA
SCHEMBL4938720 0.96 LMNA (0.32) LMNA
Potassium Ion SCHEMBL16669384 0.96 LMNA (0.32) LMNA
SCHEMBL10825969 0.84 LMNA (0.43) LMNA
SCHEMBL16669165 0.78
SCHEMBL4932994 0.76
SCHEMBL4933973 0.74 LMNA (0.40) LMNA
SCHEMBL30891614 0.74 TSHR (0.35) LMNA

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
US-11193915-B2 Composite material for the detection of chemical species INSTITUT NATIONAL D'OPTIQUE (CA) 2021-12-07 US claimed
US-20190017978-A1 COMPOSITE MATERIAL FOR THE DETECTION OF CHEMICAL SPECIES INSTITUT NATIONAL D'OPTIQUE (CA) 2019-01-17 US claimed
WO-2017088069-A1 COMPOSITE MATERIAL FOR THE DETECTION OF CHEMICAL SPECIES INSTITUT NATIONAL D'OPTIQUE (CA) 2017-06-01 WO claimed
US-8845905-B2 Polypyrrole copolymer nanoparticles-based compositions and methods for detecting lead ions TONGJI UNIVERSITY (CN) 2014-09-30 US claimed
US-20140183062-A1 POLYPYRROLE COPOLYMER NANOPARTICLES-BASED COMPOSITIONS AND METHODS FOR DETECTING LEAD LIONS TONGJI UNIVERSITY (CN) 2014-07-03 US claimed
WO-2013138978-A1 POLYPYRROLE COPOLYMER NANOPARTICLES-BASED COMPOSITIONS AND METHODS FOR DETECTING LEAD IONS TONGJI UNIVERSITY (CN) 2013-09-26 WO claimed
US-11193915-B2 Composite material for the detection of chemical species INSTITUT NATIONAL D'OPTIQUE (CA) 2021-12-07 US disclosed
US-20190017978-A1 COMPOSITE MATERIAL FOR THE DETECTION OF CHEMICAL SPECIES INSTITUT NATIONAL D'OPTIQUE (CA) 2019-01-17 US disclosed
WO-2017088069-A1 COMPOSITE MATERIAL FOR THE DETECTION OF CHEMICAL SPECIES INSTITUT NATIONAL D'OPTIQUE (CA) 2017-06-01 WO disclosed
US-8845905-B2 Polypyrrole copolymer nanoparticles-based compositions and methods for detecting lead ions TONGJI UNIVERSITY (CN) 2014-09-30 US disclosed
US-20140183062-A1 POLYPYRROLE COPOLYMER NANOPARTICLES-BASED COMPOSITIONS AND METHODS FOR DETECTING LEAD LIONS TONGJI UNIVERSITY (CN) 2014-07-03 US disclosed
US-8765060-B2 Chemical sensor REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2014-07-01 US disclosed
WO-2013138978-A1 POLYPYRROLE COPOLYMER NANOPARTICLES-BASED COMPOSITIONS AND METHODS FOR DETECTING LEAD IONS TONGJI UNIVERSITY (CN) 2013-09-26 WO disclosed
US-20080293997-A1 Chemical Sensor NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-11-27 US disclosed
EP-1888330-A2 CHEMICAL SENSOR The Regents of the University of Minnesota (US) 2008-02-20 EP disclosed
WO-2006127963-A2 CHEMICAL SENSOR REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2006-11-30 WO disclosed