SCHEMBL9068786

SCHEMBL9068786

O=[N+]([O-])c1ccc(C(Br)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ACHE P22303 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
PHLPP2 Q6ZVD8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
CES1 P23141 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
LOXL2 Q9Y4K0 1/20 0.45
CA12 O43570 1/20 0.45

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
SCHEMBL7521622 0.92 ALDH1A1 (0.58) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL5842043 0.86 ALDH1A1 (0.52) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL11442189 0.85 APP (0.55) ALDH1A1MAPTHSD17B10TDP1CYP1A2
SCHEMBL18138449 0.83 ALDH1A1 (0.53) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL29013795 0.82 ALDH1A1 (0.50) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL678502 0.82 HSD17B10 (0.52) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL6375527 0.82 ALDH1A1 (0.48) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL11034574 0.82 ALDH1A1 (0.48) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL6823057 0.82 ALDH1A1 (0.48) ALDH1A1MAPTHSD17B10TDP1ACHE
SCHEMBL1047553 0.80 MAPT (0.70) ALDH1A1MAPTHSD17B10TDP1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578415-A THIN FILM WITH LUSTER LAYER COMPRISING HYDROPHOBIC BINDER, METALLIC PARTICLES AND A TRANSPARENT PROTECTIVE FILM; LASER RECORDING, READING ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1996-11-26 US disclosed
EP-0361204-B1 Optical recording materials, method for preparing the same and optical cards having the same ASAHI CHEMICAL IND (JP) 1994-11-30 EP disclosed
EP-0361204-A2 Optical recording materials, method for preparing the same and optical cards having the same Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-04-04 EP disclosed
US-4327176-A IMPACT RESISTANT ACRYLIC ESTER RESIN BINDER ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-04-27 US disclosed
US-4268626-A Dry image forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-05-19 US disclosed
US-4188226-A OXIDIZER, REDUCER, HALOGENATED CARBOCYCLIC COMPOUND ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1980-02-12 US disclosed