SCHEMBL9561768

SCHEMBL9561768

O=S(=O)(C/C=C/c1ccccc1)CCCl

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.43
PPARG P37231 3/20 0.40
LMNA P02545 1/20 0.40
NFE2L2 Q16236 1/20 0.40
IDO1 P14902 2/20 0.39
HTR2A P28223 3/20 0.37
MAOB P27338 1/20 0.37
ALDH1A1 P00352 2/20 0.36
ALDH3A1 P30838 1/20 0.36
RCE1 Q9Y256 1/20 0.36

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
SCHEMBL9359197 1.00 PAM (0.43) PAMPPARGLMNANFE2L2IDO1
SCHEMBL6465508 0.85 PAM (0.52) PAMPPARGLMNANFE2L2IDO1
SCHEMBL10986652 0.79 PAM (0.47) PAMPPARGLMNANFE2L2IDO1
SCHEMBL10701251 0.79 PAM (0.47) PAMPPARGLMNANFE2L2IDO1
SCHEMBL10990645 0.79 PAM (0.44) PAMPPARGLMNANFE2L2IDO1
SCHEMBL10986293 0.79 PAM (0.53) PAMLMNAMAOBALDH1A1
SCHEMBL10990657 0.79 PAM (0.44) PAMPPARGLMNANFE2L2IDO1
SCHEMBL10986288 0.79 PAM (0.53) PAMLMNAMAOBALDH1A1
SCHEMBL4842131 0.77 PAM (0.48) PAMPPARGLMNANFE2L2IDO1
SCHEMBL1173055 0.77 PAM (0.48) PAMPPARGLMNANFE2L2IDO1

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
EP-0530357-A1 ELEMENT AND METHOD FOR NUCLEIC ACID AMPLIFICATION AND DETECTION USING ADHERED PROBES. EASTMAN KODAK CO (US) 1993-03-10 EP disclosed
WO-1992016659-A1 ELEMENT AND METHOD FOR NUCLEIC ACID AMPLIFICATION AND DETECTION USING ADHERED PROBES EASTMAN KODAK COMPANY (US) 1992-10-01 WO disclosed