SCHEMBL1246659

SCHEMBL1246659

O=C(O)c1cccc(Br)c1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.62
SRD5A2 P31213 2/20 0.52
MIF P14174 1/20 0.49
AKR1C3 P42330 2/20 0.49
FNTA P49354 2/20 0.48
FNTB P49356 2/20 0.48
TSHR P16473 3/20 0.47
ALOX15 P16050 1/20 0.47
PRNP P04156 1/20 0.45
TP53 P04637 1/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
ALOX12 P18054 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 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
SCHEMBL2549837 0.86 AKR1C3 (0.59) NR4A1SRD5A2AKR1C3ALOX15PRNP
SCHEMBL1820530 0.83 NR4A1 (0.66) NR4A1SRD5A2AKR1C3FNTAFNTB
SCHEMBL4801729 0.80 NR4A1 (0.62) NR4A1SRD5A2AKR1C3FNTAFNTB
SCHEMBL29583954 0.80 NR4A1 (0.62) NR4A1SRD5A2AKR1C3FNTAFNTB
SCHEMBL1821327 0.80 NR4A1 (0.62) NR4A1SRD5A2AKR1C3FNTAFNTB
SCHEMBL4551433 0.80 NR4A1 (0.62) NR4A1SRD5A2AKR1C3FNTAFNTB
SCHEMBL9281265 0.79 NR4A1 (0.65) NR4A1SRD5A2MIFAKR1C3TP53
SCHEMBL29928911 0.79 NR4A1 (0.65) NR4A1SRD5A2MIFAKR1C3TP53
SCHEMBL241422 0.78 PRNP (0.56) NR4A1AKR1C3TSHRALOX15PRNP
SCHEMBL29540504 0.78 PRNP (0.56) NR4A1AKR1C3TSHRALOX15PRNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140051689-A1 Polycyclic Agents for the Treatment of Respiratory Syncytial Virus Infections BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2014-02-20 US disclosed
US-8598193-B2 Polycyclic agents for the treatment of respiratory syncytial virus infections BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2013-12-03 US disclosed
EP-2287167-A1 Polycyclic agents for the treatment of respiratory syncytial virus infections BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2011-02-23 EP disclosed
EP-1697377-A4 POLYCYCLIC AGENTS FOR THE TREATMENT OF RESPIRATORY SYNCYTIAL VIRUS INFECTIONS BIOTA SCIENT MANAGEMENT (AU) 2008-03-19 EP disclosed
US-20070287700-A1 Polycyclic agents for the treatment of respiratory syncytial virus infections BIOTA SCIENTFIC MANAGEMENMT PTY LTD. (AU) 2007-12-13 US disclosed
EP-1697377-A1 POLYCYCLIC AGENTS FOR THE TREATMENT OF RESPIRATORY SYNCYTIAL VIRUS INFECTIONS BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2006-09-06 EP disclosed
WO-2005061513-A1 POLYCYCLIC AGENTS FOR THE TREATMENT OF RESPIRATORY SYNCYTIAL VIRUS INFECTIONS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2005-07-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140051689-A1 Polycyclic Agents for the Treatment of Respiratory Syncytial Virus Infections SDHA, SDHB, NDUFB7 NR4A1 321/4885SRD5A2 1196/4885MIF 4501/4885
US-20070287700-A1 Polycyclic agents for the treatment of respiratory syncytial virus infections PAICS, SDHB, SDHA NR4A1 242/4885SRD5A2 1499/4885MIF 4647/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.