SCHEMBL28015449

SCHEMBL28015449

Cc1ccc(S(=O)(=O)O)cc1.[Co].[Fe]

nearest known ligand 0.56

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
GAA P10253 2/20 0.56
ALDH1A1 P00352 5/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
TSHR P16473 2/20 0.52
CA12 O43570 1/20 0.52
CA3 P07451 1/20 0.52
CA6 P23280 1/20 0.52
CA5A P35218 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
NT5E P21589 1/20 0.52

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
SCHEMBL14862335 0.97 GAA (0.59) GAAALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL151795 0.97 GAA (0.59) GAAALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL2597765 0.97 GAA (0.59) GAAALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL14957972 0.97 GAA (0.59) GAAALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL11299983 0.97 GAA (0.59) GAAALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL3038225 0.97 GAA (0.59) GAAALDH1A1SMN1; SMN2LMNATDP1
Methyl Alcohol SCHEMBL28015456 0.95 GAA (0.56) GAAALDH1A1SMN1; SMN2LMNATDP1
Water SCHEMBL863624 0.95 GAA (0.56) GAAALDH1A1SMN1; SMN2LMNATDP1
Water SCHEMBL21836188 0.95 GAA (0.56) GAAALDH1A1SMN1; SMN2LMNATDP1
Methyl Alcohol SCHEMBL28226410 0.95 GAA (0.56) GAAALDH1A1SMN1; SMN2LMNATDP1

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
CN-104637689-B Electrolyte, method for manufacturing the same, composition for forming the same, and capacitor comprising the same 财团法人工业技术研究院 2017-07-07 CN disclosed
CN-104637689-A Electrolyte, method for manufacturing the same, composition for forming the same, and capacitor comprising the same IND TECH RES INST 2015-05-20 CN disclosed