SCHEMBL10585273

SCHEMBL10585273

O=c1[nH]sc2cccc([N+](=O)[O-])c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ DDAH1 O94760 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CACNA1B Q00975 1/20 0.43
▸ APBA1 Q02410 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ GPR35 Q9HC97 2/20 0.41
▸ S100A4 P26447 2/20 0.41
▸ TYMS P04818 1/20 0.40
▸ ACHE P22303 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ BCHE P06276 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ PTPRC P08575 1/20 0.38

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
SCHEMBL6233538 0.72 TDP1 (0.52) ALDH1A1MAPTKDM4EDDAH1LMNA
SCHEMBL28027350 0.71 TDP1 (0.73) ALDH1A1MAPTKDM4ETDP1PARP1
SCHEMBL8596062 0.71 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EDDAH1LMNA
SCHEMBL2970289 0.71 MAPT (0.48) ALDH1A1MAPTKDM4EDDAH1LMNA
SCHEMBL725796 0.71 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EDDAH1LMNA
SCHEMBL1710671 0.71 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EDDAH1LMNA
SCHEMBL11213296 0.71 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EDDAH1LMNA
SCHEMBL9055483 0.70 GRIN2D (0.53) ALDH1A1MAPTKDM4ELMNATDP1
SCHEMBL6007713 0.70 TDP1 (0.52) ALDH1A1MAPTTDP1PARP1GPR35
SCHEMBL1799350 0.69 TYMS (0.47) ALDH1A1MAPTKDM4ELMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0331319-A1 Method for the formation of images KONICA CORPORATION (JP) 1989-09-06 — — EP disclosed
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