SCHEMBL28364705

SCHEMBL28364705

C=CCC(CCC)CS(=O)(=O)[O-].[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 5)

geneUniProtsupporting neighboursconfidence
CA12 known ✓ O43570 1/20 0.32
CA1 known ✓ P00915 1/20 0.32
CA2 known ✓ P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 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
SCHEMBL28372696 0.78 CA12 (0.32) CA12CA1CA2CA7CA14
SCHEMBL7156781 0.75 TSHR (0.38) CA12CA1CA2CA7CA14
SCHEMBL9516718 0.75 TSHR (0.38) CA12CA1CA2CA7CA14
SCHEMBL28834682 0.73 CYP3A4 (0.30)
Hydrochloric Acid SCHEMBL28456397 0.71 TSHR (0.35)
SCHEMBL2045443 0.71
SCHEMBL10493587 0.69
Acetic Acid SCHEMBL1879600 0.68 CHRM1 (0.39)
SCHEMBL125767 0.68 KDM4E (0.32) CA2
SCHEMBL25182574 0.67 TSHR (0.40) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119463273-A Thermal expansion microsphere and preparation method thereof 湖北鼎汇微电子材料有限公司 2025-02-18 CN claimed
CN-110922573-A Organic fluorine unsaturated polyester resin emulsion and preparation method thereof 湖南辰砾新材料有限公司 2020-03-27 CN claimed
CN-110922545-B Alkyl hydroxyl block polymer modified polycarboxylic slump retaining agent and preparation method thereof 湖北工业大学 2022-09-13 CN disclosed
CN-110922546-B Phenyl hydroxyl compound ATRP method modified polycarboxylic acid slump retaining agent and preparation method thereof 湖北工业大学 2022-07-05 CN disclosed
CN-114149608-A Heat-expandable microsphere with particle size of 1-100 microns prepared by emulsion polymerization 湖北大学 2022-03-08 CN disclosed
CN-110922545-A Alkyl hydroxyl block polymer modified polycarboxylic slump retaining agent and preparation method thereof 湖北工业大学 2020-03-27 CN disclosed
CN-110922546-A Phenyl hydroxyl compound ATRP method modified polycarboxylic acid slump retaining agent and preparation method thereof 湖北工业大学 2020-03-27 CN disclosed
CN-110885414-A ATRP method ester-based amide block polymer modified polycarboxylic acid water reducing agent and preparation method thereof 湖北工业大学 2020-03-17 CN disclosed
CN-110818906-A Polycarboxylate superplasticizer modified by alkyl amide block polymer by ATRP method and preparation method thereof 湖北工业大学 2020-02-21 CN disclosed