SCHEMBL2392895

SCHEMBL2392895

Nc1ccc(Cl)cc1Oc1ccc([N+](=O)[O-])cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 3/20 0.63
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
HTT P42858 1/20 0.50
TDP1 Q9NUW8 1/20 0.49
HSD17B10 Q99714 1/20 0.49
GAA P10253 2/20 0.48
PKM P14618 1/20 0.48
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 5/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 2/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
THRA P10827 1/20 0.44
NPC1 O15118 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL4965383 0.89 PDE7A (0.63) PDE7AKMT2AMEN1TDP1HSD17B10
SCHEMBL22069746 0.88 PDE7A (0.58) PDE7AKMT2AMEN1TDP1HSD17B10
SCHEMBL11511746 0.86 PDE7A (0.71) PDE7AKMT2AMEN1HSD17B10GAA
SCHEMBL11757143 0.83 PDE7A (0.78) PDE7AKMT2AMEN1TDP1HSD17B10
SCHEMBL2395683 0.82 CYP1A2 (0.54) PDE7AKMT2AMEN1HTTTDP1
SCHEMBL4965689 0.82 TTR (0.58) KMT2AMEN1TDP1GAAKDM4E
SCHEMBL10939518 0.81 HTT (0.72) PDE7AKMT2AMEN1HTTTDP1
SCHEMBL2967458 0.80 PDE7A (0.78) PDE7AKMT2AMEN1HSD17B10GAA
SCHEMBL28831074 0.79 PDE7A (0.52) PDE7AKMT2AMEN1TDP1HSD17B10
SCHEMBL11755932 0.79 PDE7A (0.76) PDE7AKMT2AMEN1HTTTDP1

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-1765768-B1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2013-11-06 EP disclosed
US-8022248-B2 3-[2-(3-Cyanophenoxy)-4-(trifluoromethyl)phenyl]propanoic acid;prostaglandin D2 inhibitor, orphan receptor CRTH2 antagonist; antiinflammatory, analgesic, antipyretic; respiratory system disorders: asthma and rhinitis; coupling amino/thio-phenyl derivatives with ester followed by hydrolysis to acid ASTRAZENECA AB (SE) 2011-09-20 US disclosed
US-20080114002-A1 Substituted Acids for the Treatment of Respiratory Diseases ASTRAZENECA AB (SE) 2008-05-15 US disclosed
EP-1765768-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-03-28 EP disclosed
WO-2006005909-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-01-19 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 (1 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-20080114002-A1 Substituted Acids for the Treatment of Respiratory Diseases HRH2, HRH1, HRH4 PDE7A 2343/4885KMT2A 1844/4885MEN1 2723/4885

“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.