SCHEMBL5186010

SCHEMBL5186010

COS(=O)(=O)[O-].C[n+]1cc[nH]c1Cc1ccccc1

nearest known ligand 0.47

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 20)

geneUniProtsupporting neighboursconfidence
CHRM1 known ✓ P11229 1/20 0.33
CHRM3 known ✓ P20309 1/20 0.33
LMNA P02545 2/20 0.47
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 3/20 0.33
RAD52 P43351 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
PKM P14618 1/20 0.33
LTA4H P09960 1/20 0.33
GLA P06280 1/20 0.32
PSMD14 O00487 1/20 0.32
HTR1A P08908 1/20 0.32
MAOA P21397 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 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
SCHEMBL521938 0.85 CALM1 (0.41) ALDH1A1KDM4EHPGDLTA4HKCNH2
Trifluoromethanesulfonic Acid SCHEMBL5583224 0.85 KCNH2 (0.39) LMNAKCNH2CA12CA1CA2
Hydrochloric Acid SCHEMBL1457612 0.83 TAAR1 (0.42) LMNAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL2453415 0.82 LAP3 (0.35) LMNALTA4H
SCHEMBL31207593 0.79 CALM1 (0.35) ALDH1A1HPGDLTA4HKCNH2TAAR1
SCHEMBL693302 0.79 LMNA (0.30) LMNA
SCHEMBL16295012 0.75
SCHEMBL61178 0.74 FUT7 (0.33) HPGDSMN1; SMN2GLAKCNH2CA2
SCHEMBL5186796 0.72 FUT7 (0.40) ALDH1A1HPGDGLAKCNH2CA2
SCHEMBL5583319 0.72 FUT7 (0.40) ALDH1A1HPGDGLAKCNH2CA2

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
EP-1869061-A2 ELECTROCHEMICAL DEBLOCKING SOLUTION FOR ELECTROCHEMICAL OLIGOMER SYNTHESIS ON AN ELECTRODE ARRAY Combimatrix Corporation (US) 2007-12-26 EP claimed
EP-1805206-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE Combimatrix Corporation (US) 2007-07-11 EP claimed
WO-2006105037-A2 ELECTROCHEMICAL DEBLOCKING SOLUTION FOR ELECTROCHEMICAL OLIGOMER SYNTHESIS ON AN ELECTRODE ARRAY COMBIMATRIX CORPORATION (US) 2006-10-05 WO claimed
WO-2006031814-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE COMBIMATRIX CORPORATION (US) 2006-03-23 WO claimed
EP-1869061-A2 ELECTROCHEMICAL DEBLOCKING SOLUTION FOR ELECTROCHEMICAL OLIGOMER SYNTHESIS ON AN ELECTRODE ARRAY Combimatrix Corporation (US) 2007-12-26 EP disclosed
EP-1805206-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE Combimatrix Corporation (US) 2007-07-11 EP disclosed
WO-2006105037-A2 ELECTROCHEMICAL DEBLOCKING SOLUTION FOR ELECTROCHEMICAL OLIGOMER SYNTHESIS ON AN ELECTRODE ARRAY COMBIMATRIX CORPORATION (US) 2006-10-05 WO disclosed
WO-2006031814-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE COMBIMATRIX CORPORATION (US) 2006-03-23 WO disclosed