SCHEMBL2052852

SCHEMBL2052852

NC(=O)C(Oc1ccccc1)C(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TDP1 Q9NUW8 1/20 0.43
ELANE P08246 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
PARP10 Q53GL7 2/20 0.40
SLC1A3 P43003 1/20 0.39
PRSS1 P07477 1/20 0.39
ACR P10323 1/20 0.39
TMPRSS15 P98073 1/20 0.39
LDHA P00338 1/20 0.39
HPGD P15428 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL995776 0.82 LDHA (0.52) MEN1KMT2AALDH1A1GAAPARP10
SCHEMBL5411510 0.79 MTNR1A (0.45) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL22209161 0.78 TDP1 (0.43) L3MBTL1TDP1MEN1KMT2AALDH1A1
SCHEMBL7806645 0.76 ATM (0.50) ATML3MBTL1TDP1ELANEMEN1
SCHEMBL8122364 0.76 ATM (0.54) ATML3MBTL1TDP1ELANEMEN1
SCHEMBL28170097 0.76 ELANE (0.50) ATML3MBTL1TDP1ELANEMEN1
SCHEMBL28193187 0.74 ATM (0.45) ATML3MBTL1TDP1ELANEMEN1
SCHEMBL11884465 0.74 PARP10 (0.45) L3MBTL1TDP1MEN1KMT2AALDH1A1
SCHEMBL2560281 0.73 LDHA (0.65) GAALDHAALOX15CYP1A2CYP2D6
SCHEMBL31086956 0.73 ATM (0.55) ATML3MBTL1TDP1ELANEMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-11-03 US disclosed
US-8022063-B2 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-09-20 US disclosed
EP-2336113-A1 CRTH2 Receptor Ligands for Medical Use 7TM Pharma A/S (DK) 2011-06-22 EP disclosed
US-20090099189-A1 CRTH2 Receptor Ligands For Medicinal Uses 7TM PHARMA A/S (DK) 2009-04-16 US disclosed
US-20080312220-A1 Oxadiazole Derivatives with Crth2 Receptor Activity 7TM PHARMA A/S (DK) 2008-12-18 US disclosed
EP-1960376-A1 OXADIAZOLE DERIVATIVES WITH CRTH2 RECEPTOR ACTIVITY 7TM Pharma A/S (DK) 2008-08-27 EP disclosed
WO-2007062677-A1 THIAZOLYL- AND PYRIMIDINYL-ACETIC ACIDS AND THEIR USE AS CRTH2 RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2007-06-07 WO disclosed
WO-2007062678-A1 PHENOXYACETIC ACID DERIVATIVES AS CRTH2 RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2007-06-07 WO disclosed
WO-2007062773-A1 OXADIAZOLE DERIVATIVES WITH CRTH2 RECEPTOR ACTIVITY 7TM PHARMA A/S (DK) 2007-06-07 WO disclosed
EP-1758579-A1 CRTH2 RECEPTOR LIGANDS FOR MEDICINAL USES 7TM Pharma A/S (DK) 2007-03-07 EP disclosed
WO-2005115382-A1 CRTH2 RECEPTOR LIGANDS FOR MEDICINAL USES 7TM PHARMA A/S (DK) 2005-12-08 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 (3 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-20080312220-A1 Oxadiazole Derivatives with Crth2 Receptor Activity HRH2, HRH1, HRH3 ATM 2595/4885L3MBTL1 4155/4885TDP1 4861/4885
US-20090099189-A1 CRTH2 Receptor Ligands For Medicinal Uses HRH1, HRH2, HRH3 ATM 2953/4885L3MBTL1 2606/4885TDP1 4874/4885
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses HRH1, HRH2, HRH4 ATM 2755/4885L3MBTL1 2813/4885TDP1 4873/4885

“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.