SCHEMBL28405193

SCHEMBL28405193

CC(C)CCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]

nearest known ligand 0.44

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
CA1 known ✓ P00915 1/20 0.33
CA2 known ✓ P00918 1/20 0.31
LMNA P02545 2/20 0.44
GMNN O75496 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
THPO P40225 1/20 0.44
HBB P68871 1/20 0.44
PMP22 Q01453 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ENPEP Q07075 2/20 0.44
FUT7 Q11130 1/20 0.44
BBOX1 O75936 3/20 0.41
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
EPHX2 P34913 1/20 0.36
NR1I2 O75469 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
SCHEMBL9488835 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL18007807 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL18007994 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL28389009 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL28407388 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL18008307 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL1111412 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL11206429 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL3418083 1.00 LMNA (0.44) LMNAGMNNALDH1A1TP53TSHR
SCHEMBL18008272 0.98 LMNA (0.46) LMNAGMNNALDH1A1TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115151310-B Sulfur-containing anti-dandruff compositions with enhanced efficacy and aesthetics 宝洁公司 2024-12-20 CN claimed
CN-117413100-A Diluent of treating agent for synthetic fiber and use thereof 松本油脂制药株式会社 2024-01-16 CN disclosed
CN-115298388-B Treating agent for synthetic fiber and use thereof 松本油脂制药株式会社 2023-07-07 CN disclosed
CN-110016811-B Treating agent for synthetic fiber and synthetic fiber 竹本油脂株式会社 2022-07-22 CN disclosed
CN-111247288-B Treating agent for synthetic fiber and synthetic fiber 竹本油脂株式会社 2021-01-22 CN disclosed
CN-111247287-B Treating agent for synthetic fiber and synthetic fiber 竹本油脂株式会社 2021-01-22 CN disclosed
CN-111247288-A Treating agent for synthetic fiber and synthetic fiber 竹本油脂株式会社 2020-06-05 CN disclosed
CN-111247287-A Treating agent for synthetic fiber and synthetic fiber 竹本油脂株式会社 2020-06-05 CN disclosed