Perchlorate

Perchlorate

SCHEMBL9506193

Cc1cc(N(C)C)ccc1C=C1CCC(=Cc2ccc(N(C)C)cc2C)C1.[O-][Cl+3]([O-])([O-])O

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.36
ACHE P22303 5/20 0.36
MAPT P10636 2/20 0.36
APP P05067 2/20 0.34
TERT O14746 1/20 0.34
PTGS2 P35354 6/20 0.33
BCHE P06276 2/20 0.33
PSMB5 P28074 3/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HSP90AA1 P07900 1/20 0.30
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
Perchlorate SCHEMBL9507765 0.94 ACHE (0.40) APAF1ACHEMAPTPTGS2BCHE
Perchlorate SCHEMBL9509765 0.77 CYP1A2 (0.45) MAPTAPPMEN1NPC1ALDH1A1
Perchlorate SCHEMBL9506200 0.72 CYP1A2 (0.50) MAPTAPPKDM4EMEN1NPC1
SCHEMBL9508653 0.70 ACHE (0.58) ACHEMAPTPTGS2BCHEMEN1
SCHEMBL9506413 0.68 ACHE (0.67) ACHEMAPTPTGS2BCHEMEN1
Perchlorate SCHEMBL2477884 0.66 APP (0.59) APAF1APPTERTPTGS2PSMB5
SCHEMBL3669876 0.66 APAF1 (0.43) APAF1MAPTAPPTERTPTGS2
SCHEMBL143348 0.66 CYP2A6 (0.48) APAF1MAPTAPPTERTPTGS2
SCHEMBL14391188 0.65 APAF1 (0.41) APAF1ACHEMAPTAPPTERT
Perchlorate SCHEMBL9507756 0.65 MAPT (0.51) MAPTAPPKDM4EMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0364120-B1 A CYCLOALKENE COMPOUND AND A RECORDING MATERIAL USING THE COMPOUND HODOGAYA CHEMICAL COMPANY, LIMITED (JP) 1993-08-11 EP disclosed
US-4987262-A Absorbers of near infrared radiation, chromogens HODOGAYA CHEMICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0364120-A2 A cycloalkene compound and a recording material using the compound HODOGAYA CHEMICAL COMPANY, LIMITED (JP) 1990-04-18 EP disclosed