SCHEMBL29474451

SCHEMBL29474451

CCCCCCCCCCOCCOCCS(=O)(=O)[O-].[Na+]

nearest known ligand 0.55

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 20)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 1/20 0.48
CA1 known ✓ P00915 9/20 0.42
CA2 known ✓ P00918 9/20 0.42
CA12 known ✓ O43570 3/20 0.42
CA4 known ✓ P22748 2/20 0.42
RECQL P46063 2/20 0.55
EPHX2 P34913 2/20 0.55
TSHR P16473 2/20 0.55
GLA P06280 1/20 0.55
HPGD P15428 1/20 0.55
MAPK1 P28482 1/20 0.55
BLM P54132 1/20 0.55
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 1/20 0.48
CA9 Q16790 8/20 0.42
CA7 P43166 3/20 0.42
CA14 Q9ULX7 3/20 0.42
CA3 P07451 2/20 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
SCHEMBL29930427 1.00 RECQL (0.55) RECQLEPHX2TSHRGLAHPGD
SCHEMBL10525027 0.98 RECQL (0.57) RECQLEPHX2TSHRGLAHPGD
SCHEMBL9777699 0.98 RECQL (0.57) RECQLEPHX2TSHRGLAHPGD
SCHEMBL122978 0.92 RECQL (0.55) RECQLEPHX2TSHRGLAHPGD
SCHEMBL124817 0.92 RECQL (0.55) RECQLEPHX2TSHRGLAHPGD
SCHEMBL699887 0.92 RECQL (0.55) RECQLEPHX2TSHRGLAHPGD
SCHEMBL28091240 0.91 RECQL (0.53) RECQLEPHX2TSHRGLAHPGD
SCHEMBL28077320 0.90 RECQL (0.57) RECQLEPHX2TSHRGLAHPGD
SCHEMBL31690464 0.90 TSHR (0.45) RECQLEPHX2TSHRGLAHPGD
SCHEMBL10525328 0.88 EPHX2 (0.54) RECQLEPHX2TSHRGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11415904-B2 Image forming method and image forming system Konica Minolta, Inc. (JP) 2022-08-16 US disclosed
US-20220057724-A1 IMAGE FORMING METHOD AND IMAGE FORMING SYSTEM Konica Minolta, Inc. (JP) 2022-02-24 US disclosed