SCHEMBL5565461

SCHEMBL5565461

CC(=O)Nc1c(I)cc([N+](=O)[O-])c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
LMNA P02545 4/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
HTT P42858 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
MAPK1 P28482 1/20 0.47
OPRK1 P41145 1/20 0.47
ATM Q13315 1/20 0.46
CTSB P07858 1/20 0.44
KDM4E B2RXH2 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
IDO1 P14902 1/20 0.43
GAA P10253 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL31490630 0.84 MAPT (0.51) MAPTALDH1A1HPGDLMNAMEN1
SCHEMBL18122169 0.78 CTSB (0.53) MAPTALDH1A1HPGDLMNAMEN1
SCHEMBL30064935 0.77 KCNJ11 (0.53) MAPTALDH1A1HPGDLMNAMEN1
SCHEMBL6839572 0.77 KCNJ11 (0.53) MAPTALDH1A1HPGDLMNAMEN1
SCHEMBL7112387 0.77 KCNJ11 (0.66) MAPTALDH1A1HPGD
SCHEMBL15303135 0.74 TDP1 (0.51) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL26529166 0.74 MAPT (0.43) MAPTALDH1A1HPGDLMNAMEN1
SCHEMBL645403 0.74 RXFP1 (0.58) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL18122171 0.74 HTT (0.46) MAPTALDH1A1HPGDLMNAMEN1
SCHEMBL28620655 0.74 MAPT (0.45) MAPTALDH1A1HPGDLMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1769286-A2 OXIME DERIVATIVES AND THE USE THEROF AS LATENT ACIDS Ciba Specialty Chemicals Holding Inc. (CH) 2007-04-04 EP disclosed
WO-2006008250-A2 OXIME DERIVATIVES AND THE USE THEROF AS LATENT ACIDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-01-26 WO disclosed
US-6010820-A COMPOUND CAPABLE OF GENERTING SULFONIC ACID UPON IRRADIATION FUJI PHOTO FILM CO., LTD. (JP) 2000-01-04 US disclosed
EP-0179921-A1 BASE MATERIAL HAVING A DYED SURFACE FILM AND DYEING METHOD NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1986-05-07 EP disclosed