SCHEMBL5583319

SCHEMBL5583319

CCCCCCCCc1[nH]cc[n+]1C.COS(=O)(=O)[O-]

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

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 18)

geneUniProtsupporting neighboursconfidence
FUT7 Q11130 1/20 0.40
KCNH2 Q12809 7/20 0.37
RECQL P46063 2/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
EPHX2 P34913 1/20 0.35
BLM P54132 1/20 0.35
GPR84 Q9NQS5 3/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALOX5 P09917 5/20 0.32
PTGS2 P35354 3/20 0.32
GLS2 Q9UI32 1/20 0.32
CA2 P00918 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
SCHEMBL5186796 1.00 FUT7 (0.40) FUT7KCNH2RECQLGLAHPGD
SCHEMBL61178 0.94 FUT7 (0.33) FUT7KCNH2RECQLGLAHPGD
Sulfuric Acid SCHEMBL2554779 0.89 KCNH2 (0.39) FUT7KCNH2GPR84CA2
SCHEMBL5961710 0.88 RECQL (0.53) FUT7KCNH2RECQLGLAHPGD
SCHEMBL5961715 0.88 RECQL (0.53) FUT7KCNH2RECQLGLAHPGD
SCHEMBL5961714 0.88 RECQL (0.53) FUT7KCNH2RECQLGLAHPGD
SCHEMBL2453688 0.88 RECQL (0.53) FUT7KCNH2RECQLGLAHPGD
SCHEMBL20288 0.85 RECQL (0.53) FUT7KCNH2RECQLGLAHPGD
SCHEMBL5961699 0.85 RECQL (0.53) FUT7KCNH2RECQLGLAHPGD
Sulfuric Acid SCHEMBL5983597 0.85 CA2 (0.34) KCNH2HPGDCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1805206-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE Combimatrix Corporation (US) 2007-07-11 EP claimed
WO-2006031814-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE COMBIMATRIX CORPORATION (US) 2006-03-23 WO claimed
EP-3229959-A1 HIGH EFFICIENCY, SMALL VOLUME NUCLEIC ACID SYNTHESIS Life Technologies Corporation (US) 2017-10-18 EP disclosed
WO-2016094512-A1 HIGH EFFICIENCY, SMALL VOLUME NUCLEIC ACID SYNTHESIS yLIFE TECHNOLOGIES CORPORATION (US) 2016-06-16 WO disclosed
EP-1805206-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE Combimatrix Corporation (US) 2007-07-11 EP disclosed
WO-2006031814-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE COMBIMATRIX CORPORATION (US) 2006-03-23 WO disclosed