SCHEMBL8749219

SCHEMBL8749219

[N-]=[N+]=C1C(=O)OC(Cc2ccccc2)(Cc2ccccc2)OC1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.34
MAOA P21397 7/20 0.33
MAOB P27338 7/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CTSG P08311 2/20 0.33
PRTN3 P24158 1/20 0.33
KDM1A O60341 4/20 0.32
NR3C2 P08235 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
CACNA1B Q00975 1/20 0.31

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
SCHEMBL7781925 0.73 GAA (0.43) ELANEL3MBTL1CTSGPRTN3ALDH1A1
SCHEMBL8123163 0.72 MAOA (0.41) ELANEMAOAMAOBLMNAHTT
SCHEMBL10926238 0.69 SIRT1 (0.46) HTTNPSR1KDM4EALDH1A1CYP1A2
SCHEMBL7789545 0.63 PTPN1 (0.39) LMNAHTTL3MBTL1ALDH1A1MAPT
SCHEMBL3966742 0.63 ELANE (0.42) ELANEMAOAMAOBLMNAHTT
SCHEMBL14779625 0.62 MAOA (0.46) MAOAMAOBLMNAHTTNPSR1
SCHEMBL16174809 0.62 ELANE (0.49) ELANELMNANPSR1CTSGPRTN3
SCHEMBL10525604 0.62 MAOB (0.42) ELANEMAOAMAOBLMNAHTT
SCHEMBL8749165 0.62 PTPN1 (0.41)
SCHEMBL16175012 0.61 ELANE (0.51) ELANELMNANPSR1CTSGPRTN3

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
US-5627006-A ALKENYLOXY-SUBSTITUTED POLYVINYLPHENOLS, PHOTOSENSITIVE ACID GENERATOR WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-06 US disclosed
EP-0552548-B1 Resist material WAKO PURE CHEM IND LTD (JP) 1997-03-19 EP disclosed
EP-0552548-A1 Resist material WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1993-07-28 EP disclosed