SCHEMBL3179873

SCHEMBL3179873

O=[N+]([O-])c1cc2cc3ccccc3cc2c([N+](=O)[O-])c1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.56
CASP6 P55212 1/20 0.49
ALDH1A1 P00352 2/20 0.47
TSHR P16473 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
HPRT1 P00492 1/20 0.45
MEN1 O00255 2/20 0.43
RAB9A P51151 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
APEX1 P27695 1/20 0.40
NPC1 O15118 1/20 0.39
S100A4 P26447 1/20 0.38
GPR35 Q9HC97 1/20 0.38
CDK2 P24941 1/20 0.38
HSD17B10 Q99714 1/20 0.37
CTSB P07858 1/20 0.37

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
SCHEMBL188171 0.85 CYP3A4 (0.71) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL122680 0.82 CYP3A4 (0.61) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL28837938 0.82 CYP3A4 (0.39) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL2359326 0.81 CYP3A4 (0.47) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL27665520 0.81 CYP3A4 (0.64) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL29054358 0.80 CYP3A4 (0.46) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL31549326 0.78 CASP6 (0.59) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL11203665 0.78 CASP6 (0.59) CYP3A4CASP6ALDH1A1TSHRTDP1
SCHEMBL28322471 0.77 CASP6 (0.75) CYP3A4CASP6ALDH1A1TSHRTDP1
Anthracene SCHEMBL8585699 0.77 ALDH1A1 (0.59) CYP3A4CASP6ALDH1A1TSHRTDP1

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 88 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115028759-A Laser manufacturing method based on triplet state up-conversion and application thereof 华中科技大学 2022-09-09 CN claimed
EP-0017513-B2 ELECTROPHOTOGRAPHIC MEMBER AND PROCESS FOR FORMING A LATENT IMAGE RANK XEROX LIMITED (GB) 1986-12-30 EP claimed
EP-0017513-B1 ELECTROPHOTOGRAPHIC MEMBER AND PROCESS FOR FORMING A LATENT IMAGE RANK XEROX LIMITED (GB) 1983-01-19 EP claimed
US-4315980-A ELECTRON ACCEPTOR ACTIVATORS FUJI XEROX CO., LTD. (JP) 1982-02-16 US claimed
EP-0017513-A1 Electrophotographic member and process for forming a latent image RANK XEROX LIMITED (GB) 1980-10-15 EP claimed
CN-115028759-A Laser manufacturing method based on triplet state up-conversion and application thereof 华中科技大学 2022-09-09 CN disclosed
US-7648811-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2010-01-19 US disclosed
US-7396895-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2008-07-08 US disclosed
US-20080118853-A1 BRANCHED POLYARYLENE ETHERS AND PROCESSES FOR THE PREPARATION THEREOF XEROX CORPORATION (US) 2008-05-22 US disclosed
CN-100370362-C Stilbene inducer, process for producing the same, and electrophotographic photoconductor KYOCERA MITA CORP (JP) 2008-02-20 CN disclosed
US-7067608-B2 Process for preparing branched polyarylene ethers XEROX CORPORATION (US) 2006-06-27 US disclosed
US-20050208416-A1 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION 2005-09-22 US disclosed
US-4111693-A PYRYLIUM TYPE DYE SALT EASTMAN KODAK COMPANY (US) 1978-09-05 US disclosed
US-4106934-A ELECTROGRAPHY EASTMAN KODAK COMPANY (US) 1978-08-15 US disclosed
US-4092162-A Nitrogen containing polymers aelements EASTMAN KODAK COMPANY (US) 1978-05-30 US disclosed
US-4081274-A Composite layered photoreceptor XEROX CORPORATION (US) 1978-03-28 US disclosed
US-4078925-A Composite layered photoreceptor XEROX CORPORATION (US) 1978-03-14 US disclosed
US-4047948-A Composite layered imaging member for electrophotography XEROX CORPORATION (US) 1977-09-13 US disclosed
US-4047949-A Composite layered imaging member for electrophotography XEROX CORPORATION (US) 1977-09-13 US disclosed
US-3953207-A Composite layered photoreceptor XEROX CORPORATION (US) 1976-04-27 US disclosed