SCHEMBL6542949

SCHEMBL6542949

[Na+].[Na+].[Na+].[O-]C=S.[O-]C=S.[O-]C=S

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL587067 1.00
SCHEMBL5574223 0.86
SCHEMBL5574870 0.86
SCHEMBL11883101 0.86
SCHEMBL10631620 0.86
SCHEMBL8641360 0.86
Formic Acid SCHEMBL2354 0.57
Formic Acid SCHEMBL5235342 0.57 ALDH1A1 (0.33)
Formic Acid SCHEMBL1332681 0.57
Formic Acid SCHEMBL6906941 0.57

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6797195-B1 Method for recovering and separating metals from waste streams YA GLOBAL INVESTMENTS, L.P. 2004-09-28 US disclosed
US-6274045-B1 UNIQUE COMPLEXING AGENT COMPRISING A THIOCARBAMATE COMPOUND AND AN ALKALI METAL HYDROXIDE WHICH FACILITATES THE FORMATION OF THE METALS INTO IONIC METAL PARTICLES ENABLING THEM TO BE READILY SEPARATED, REMOVED AND RECOVERED. YA GLOBAL INVESTMENTS, L.P. 2001-08-14 US disclosed
US-6270679-B1 COMPLEXING CADMIUM OR LEAD WITH SODIUM, POTASSIUM, OR CALCIUM HYDROXIDE AND SODIUM OR ZINC DIMETHYLDITHIOCARBAMATE; PRECIPITATING SLUDGE; DRYING, MELTING YA GLOBAL INVESTMENTS, L.P. 2001-08-07 US disclosed
US-6254782-B1 FEEDING LIQUID MINE WASTE AND MINE EFFLUENT INTO CHAMBER; ADJUSTING PH; ADDING COMPLEXING AGENT, FLOCCULATING AGENT AND CALCIUM CHLORIDE AS AN AGGREGATING AGENT; DEWATERING,DRYING, AND MELTING SLUDGE; DISCHARGING EFFLUENT YA GLOBAL INVESTMENTS, L.P. 2001-07-03 US disclosed
WO-1999034926-A1 METHOD FOR RECOVERING AND SEPARATING METALS FROM WASTE STREAMS KREISLER LAWRENCE (US) 1999-07-15 WO disclosed
US-5908559-A Method for recovering and separating metals from waste streams YA GLOBAL INVESTMENTS, L.P. 1999-06-01 US disclosed
US-4395418-A 6-HYDROXYETHYL SUBSTITUTED ANTIBIOTICS SANKYO COMPANY LIMITED (JP) 1983-07-26 US disclosed