SCHEMBL333018

SCHEMBL333018

O=C(c1ccccc1)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 2/20 1.00
MAPT P10636 5/20 0.69
MAPK1 P28482 4/20 0.69
ALDH1A1 P00352 4/20 0.69
LMNA P02545 3/20 0.69
RAF1 P04049 1/20 0.69
HPGD P15428 1/20 0.69
GFER P55789 1/20 0.69
PAX8 Q06710 1/20 0.69
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
SMN1; SMN2 Q16637 5/20 0.58
L3MBTL1 Q9Y468 1/20 0.56
HTT P42858 3/20 0.56
GAA P10253 2/20 0.56
KDM4E B2RXH2 1/20 0.55
NPC1 O15118 1/20 0.54
MITF O75030 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54

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
SCHEMBL28115730 0.98 VCAM1 (0.97) VCAM1MAPTMAPK1ALDH1A1LMNA
Ethyne SCHEMBL11571141 0.97 VCAM1 (0.94) VCAM1MAPTMAPK1ALDH1A1LMNA
Methylamine SCHEMBL28114180 0.94 VCAM1 (0.89) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL8625340 0.93 VCAM1 (0.96) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL28777157 0.93 VCAM1 (0.86) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL8625278 0.92 VCAM1 (0.87) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL1258621 0.92 VCAM1 (1.00) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL10383201 0.89 VCAM1 (0.87) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL8626291 0.87 VCAM1 (0.84) VCAM1MAPTMAPK1ALDH1A1LMNA
SCHEMBL4609541 0.87 VCAM1 (0.77) VCAM1MAPTMAPK1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110938007-B Dicofol hapten, artificial antigen, antibody, synthetic method and application thereof 深圳市易瑞生物技术股份有限公司 2022-11-11 CN claimed
EP-4061347-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA Vestlandets Innovasjonsselskap AS (NO) 2022-09-28 EP claimed
CN-109467512-B Synthetic method of 3, 4-diamino-benzophenone 苏州开元民生科技股份有限公司 2021-06-08 CN claimed
WO-2021099803-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2021-05-27 WO claimed
CN-110938007-A Dicofol hapten, artificial antigen, antibody, synthetic method and application thereof 深圳市易瑞生物技术股份有限公司 2020-03-31 CN claimed
EP-3470491-A1 PHOSPHORUS-CONTAINING STABILIZERS FOR FLUOROOLEFINS The Chemours Company FC, LLC (US) 2019-04-17 EP claimed
EP-2410032-B1 Phosphorus-containing stabilizers for fluoroolefins CHEMOURS CO FC LLC (US) 2018-11-14 EP claimed
US-20170362483-A1 EPOXIDE AND FLUORINATED EPOXIDE STABILIZERS FOR FLUOROOLEFINS THE CHEMOURS COMPANY FC, LLC 2017-12-21 US claimed
CN-107033007-A A kind of synthetic method of the chloro benzophenone of 3 nitro 4 陕西蒲城万德科技有限公司 2017-08-11 CN claimed
EP-2420546-B1 Terephthalate stabilizers for fluoroolefins CHEMOURS CO FC LLC (US) 2017-04-26 EP claimed
WO-2008027511-A1 EPOXIDE AND FLUORINATED EPOXIDE STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2008027515-A2 PHOSPHORUS-CONTAINING STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2008027594-A2 PHENOL STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2008027512-A2 FUNCTIONALIZED PERFLUOROPOLYETHER STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2008027596-A2 BENZOPHENONE DERIVATIVE STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2008027519-A1 OXETANE STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2008027517-A1 THIOL AND THIOETHER STABILIZERS FOR FLUOROOLEFINS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-06 WO claimed
WO-2007126760-A2 COMPOSITIONS COMPRISING IODOTRIFLUOROMETHANE AND STABILIZERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-11-08 WO claimed
CN-1809362-A Substituted 1,4-diazepines and uses thereof JOHNSON & JOHNSON (US) 2006-07-26 CN claimed
CN-1599611-A Piperazine derivatives for use as CCR-3 receptor antagonists in the treatment of asthma HOFFMANN LA ROCHE (CH) 2005-03-23 CN claimed