SCHEMBL5158512

SCHEMBL5158512

CCCCCCCC/C=C\CCCCCCC(C)C(=O)NCCS(=O)(=O)[O-].[Na+]

nearest known ligand 0.60

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 3)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 1/20 0.41
EPHX2 P34913 2/20 0.60
CNR1 P21554 6/20 0.55

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
SCHEMBL11686156 0.92 CA1 (0.47) EPHX2CNR1CA1
SCHEMBL9327564 0.92 CA1 (0.47) EPHX2CNR1CA1
SCHEMBL28921026 0.92 CA1 (0.47) EPHX2CNR1CA1
SCHEMBL5151784 0.87 EPHX2 (0.59) EPHX2CNR1
SCHEMBL5617374 0.86 EPHX2 (0.58) EPHX2CNR1
SCHEMBL17547704 0.84 CNR1 (0.66) EPHX2CNR1
SCHEMBL6822792 0.81 CNR1 (0.80) CNR1
SCHEMBL5184657 0.81 CNR1 (0.80) CNR1
SCHEMBL5182536 0.81 CNR1 (0.80) CNR1
SCHEMBL19458429 0.79 EPHX2 (0.65) EPHX2CNR1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9696241-B2 Liquid sampling, storage, transfer and delivery device POREX CORPORATION (US) 2017-07-04 US disclosed
EP-2699884-B1 LIQUID SAMPLING, STORAGE, TRANSFER AND DELIVERY DEVICE POREX CORP (US) 2017-01-04 EP disclosed
US-20160349153-A1 Liquid Sampling, Storage, Transfer and Delivery Device POREX CORPORATION (US) 2016-12-01 US disclosed
US-20150079614-A1 Liquid Sampling, Storage, Transfer and Delivery Device POREX CORPORATION (US) 2015-03-19 US disclosed
US-8920339-B2 Liquid sampling, storage, transfer and delivery device POREX CORPORATION (US) 2014-12-30 US disclosed
US-8852122-B2 Liquid sampling, storage, transfer and delivery device POREX CORPORATION (US) 2014-10-07 US disclosed
US-20140249451-A1 Liquid Sampling, Storage, Transfer and Delivery Device POREX CORPORATION (US) 2014-09-04 US disclosed
EP-2699884-A1 LIQUID SAMPLING, STORAGE, TRANSFER AND DELIVERY DEVICE Porex Corporation (US) 2014-02-26 EP disclosed
US-20140018701-A1 Liquid Sampling, Storage, Transfer and Delivery Device POREX CORPORATION (US) 2014-01-16 US disclosed
WO-2012145379-A1 LIQUID SAMPLING, STORAGE, TRANSFER AND DELIVERY DEVICE POREX CORPORATION (US) 2012-10-26 WO disclosed
EP-1750173-A1 Silver halide photosensitive material and packaged body containing the same Fuji Photo Film Co., Ltd. (JP) 2007-02-07 EP disclosed
US-4965180-A SUPPORT, SUBBING LAYER, AQUEOUS POLYMER LATEX FUJII PHOTO FILM CO., LTD. (JP) 1990-10-23 US disclosed
EP-0321948-A2 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1989-06-28 EP disclosed
US-3986979-A SPRAY DRYING LIGNIN SULFONATE AND ANIONIC OR NONIONIC SURFACTANT WESTVACO CORPORATION (US) 1976-10-19 US disclosed