SCHEMBL9502422

SCHEMBL9502422

O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1ccc(Cc2ccc(N3C(=O)c4cccc([N+](=O)[O-])c4C3=O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.61
CA2 P00918 4/20 0.57
CA9 Q16790 4/20 0.57
CA1 P00915 3/20 0.57
CA12 O43570 2/20 0.57
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
SCN2A Q99250 2/20 0.50
CA4 P22748 1/20 0.49
S100A4 P26447 2/20 0.47
ATM Q13315 1/20 0.46
PTPRC P08575 1/20 0.44
ADORA2A P29274 1/20 0.43
MAPT P10636 2/20 0.43
RECQL P46063 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL31259847 0.85 KDM4E (0.71) KDM4ECA2CA9CA1CA12
SCHEMBL5151001 0.85 KDM4E (0.71) KDM4ECA2CA9CA1CA12
SCHEMBL11309121 0.84 KDM4E (0.62) KDM4ECA2CA9CA1CA12
SCHEMBL11308425 0.84 KDM4E (0.62) KDM4ECA2CA9CA1CA12
Hydrochloric Acid SCHEMBL11406824 0.83 KDM4E (0.61) KDM4ECA2CA9CA1CA12
SCHEMBL11402428 0.83 KDM4E (0.61) KDM4ECA2CA9CA1CA12
SCHEMBL9870209 0.81 KDM4E (0.58) KDM4ECA2CA9CA1CA12
SCHEMBL4230682 0.81 CA9 (0.60) KDM4ECA2CA9CA1CA12
SCHEMBL4409822 0.81 KDM4E (0.58) KDM4ECA2CA9CA1CA12
SCHEMBL16863041 0.81 KDM4E (0.58) KDM4ECA2CA9CA1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0375079-B1 ALKENYLPHOXYLIMIDE MODIFIED POLYIMIDE Technochemie GmbH - Verfahrenstechnik (DE) 1993-06-09 EP disclosed
US-5120824-A Molding materials based on unsaturated monomers containing imide groups; engineering thermoplastics; toughness; heat resistance TECHNOCHEMIE GMBH VERFAHRENSTECHNIK (DE) 1992-06-09 US disclosed
EP-0375079-A2 Alkenylphoxylimide modified polyimide Technochemie GmbH - Verfahrenstechnik (DE) 1990-06-27 EP disclosed
EP-0001597-B1 UNDER LIGHT EXPOSURE HARDENABLE, BIS-AZIDOPHTHALIMIDYL COMPOUNDS CONTAINING COMPOSITIONS CIBA-GEIGY AG (CH) 1981-10-21 EP disclosed
US-4197133-A Photo-curable compositions of matter containing bis-azidophthalimidyl derivatives CIBA-GEIGY CORPORATION (US) 1980-04-08 US disclosed