SCHEMBL2851741

SCHEMBL2851741

O=C(O)c1ccc(Oc2ccccc2)o1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.51
SRD5A2 P31213 2/20 0.47
ALDH1A1 P00352 5/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 2/20 0.46
KLKB1 P03952 1/20 0.45
FFAR1 O14842 1/20 0.44
CES1 P23141 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44
AKR1C3 P42330 1/20 0.43
LTA4H P09960 1/20 0.42

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
SCHEMBL14864597 0.85 NPSR1 (0.49) NPSR1SRD5A2ALDH1A1MAPTHPGD
SCHEMBL3053443 0.85 NPSR1 (0.52) NPSR1SRD5A2ALDH1A1MAPTHPGD
SCHEMBL4155326 0.85 PARP10 (0.50) NPSR1SRD5A2ALDH1A1MAPTKLKB1
SCHEMBL8782245 0.84 SMN1; SMN2 (0.56) NPSR1ALDH1A1MAPTTDP1MEN1
SCHEMBL8783684 0.84 NR4A2 (0.45) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL13687506 0.81 NPSR1 (0.46) NPSR1SRD5A2ALDH1A1MAPTMEN1
SCHEMBL10746960 0.80 POLB (0.49) SRD5A2ALDH1A1MAPTTDP1MEN1
SCHEMBL4673037 0.79 ALDH1A1 (0.68) NPSR1ALDH1A1MAPTTDP1MEN1
SCHEMBL6644449 0.78 NR4A1 (0.44) NPSR1ALDH1A1MAPTTDP1MEN1
SCHEMBL2868499 0.78 PTGS1 (0.48) NPSR1ALDH1A1MAPTTDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8080567-B2 EP2 receptor agonists ASTERAND UK LIMITED (GB) 2011-12-20 US disclosed
US-8080567-B2 EP2 receptor agonists ASTERAND UK LIMITED (GB) 2011-12-20 US disclosed
US-8080567-B2 EP2 receptor agonists ASTERAND UK LIMITED (GB) 2011-12-20 US disclosed
US-20100130556-A1 EP2 RECEPTOR AGONISTS ASTERAND UK LIMITED (GB) 2010-05-27 US disclosed
US-20100130556-A1 EP2 RECEPTOR AGONISTS ASTERAND UK LIMITED (GB) 2010-05-27 US disclosed
US-20100130556-A1 EP2 RECEPTOR AGONISTS ASTERAND UK LIMITED (GB) 2010-05-27 US disclosed
EP-1951701-A2 EP2 RECEPTOR AGONISTS ASTERAND UK LIMITED (GB) 2008-08-06 EP disclosed
WO-2007017687-A2 EP2 RECEPTOR AGONISTS ASTERAND UK LIMITED (GB) 2007-02-15 WO disclosed
WO-2007017687-A2 EP2 RECEPTOR AGONISTS ASTERAND UK LIMITED (GB) 2007-02-15 WO disclosed
EP-0595995-B1 ARYLAMIDOALKYL- AND ARYLAMINOALKYL-N-HYDROXYUREA COMPOUNDS AND -N-HYDROXYFORMAMIDE DERIVATIVES HAVING LIPOXYGENASE INHIBITORY ACTIVITY ABBOTT LAB (US) 1997-01-15 EP disclosed
US-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed
EP-0595995-A4 ARYLAMIDOALKYL-N-HYDROXYUREA COMPOUNDS HAVING LIPOXYGENASE INHIBITORY ACTIVITY ABBOTT LAB (US) 1994-08-24 EP disclosed
EP-0595995-A1 ARYLAMIDOALKYL-N-HYDROXYUREA COMPOUNDS HAVING LIPOXYGENASE INHIBITORY ACTIVITY. ABBOTT LAB (US) 1994-05-11 EP disclosed
US-5214204-A Inhibitors of biosynthesis of leukotrienes ABBOTT LABORATORIES (US) 1993-05-25 US disclosed
WO-1993002037-A1 ARYLAMIDOALKYL-N-HYDROXYUREA COMPOUNDS HAVING LIPOXYGENASE INHIBITORY ACTIVITY ABBOTT LABORATORIES (US) 1993-02-04 WO disclosed
US-4282246-A Antidiabetic furancarboxylic and thiphenecarboxylic acids PFIZER INC. (US) 1981-08-04 US 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-20100130556-A1 EP2 RECEPTOR AGONISTS PTGER3, PTGER2, CNR2 NPSR1 66/4885SRD5A2 340/4885ALDH1A1 2720/4885

“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.