SCHEMBL1332079

SCHEMBL1332079

CCS(=O)(=O)c1ccc(Sc2cc(Cl)ccc2O)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
HSD17B10 Q99714 3/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
HTT P42858 2/20 0.53
PLA2G1B P04054 1/20 0.53
HSP90AA1 P07900 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HIF1A Q16665 1/20 0.53
ATG4B Q9Y4P1 1/20 0.53
PTGDR2 Q9Y5Y4 6/20 0.47
MAPT P10636 3/20 0.42
KDM4E B2RXH2 1/20 0.42
ESR1 P03372 4/20 0.40
CCR2 P41597 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
SCHEMBL1331620 0.88 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL1333647 0.82 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL1333490 0.82 PTGDR2 (0.48) ALDH1A1HTTPTGDR2LMNATP53
SCHEMBL1333435 0.79 PTGDR2 (0.68) PTGDR2
SCHEMBL1650523 0.75 KDM4E (0.43) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL1332199 0.74 MEN1 (0.57) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL2396187 0.73 PTGDR2 (0.50) ALDH1A1MEN1KMT2APTGDR2MAPT
Fenticlor SCHEMBL29729454 0.72 HSD17B10 (1.00) ALDH1A1MEN1KMT2AHSD17B10HPGD
Fenticlor SCHEMBL23276 0.72 HSD17B10 (1.00) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL2395796 0.72 PDE7A (0.45) ALDH1A1MEN1KMT2APTGDR2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281898-A1 PHENOXIACETIC ACID DERIVATIVES ASTRAZENECA AB 2011-11-17 US claimed
JP-2007502806-A 2007-02-15 JP claimed
US-20060293352-A1 Phenoxiacetic acid derivatives ASTRAZENECA AB (SE) 2006-12-28 US claimed
EP-1660431-A2 PHENOXYACETIC ACID DERIVATIVES Astrazeneca AB (SE) 2006-05-31 EP claimed
WO-2005018529-A2 PHENOXIACETIC ACID DERIVATIVES ASTRAZENECA AB (SE) 2005-03-03 WO claimed
US-8394986-B2 Phenoxiacetic acid derivatives ASTRAZENECA AB (GB) 2013-03-12 US disclosed
US-20110281898-A1 PHENOXIACETIC ACID DERIVATIVES ASTRAZENECA AB 2011-11-17 US disclosed
US-8003703-B2 Phenoxiacetic acid derivatives ASTRAZENECA AB (SE) 2011-08-23 US disclosed
EP-1660431-B1 PHENOXYACETIC ACID DERIVATIVES ASTRAZENECA AB (SE) 2009-04-01 EP disclosed
US-20060293352-A1 Phenoxiacetic acid derivatives ASTRAZENECA AB (SE) 2006-12-28 US disclosed
EP-1660431-A2 PHENOXYACETIC ACID DERIVATIVES Astrazeneca AB (SE) 2006-05-31 EP disclosed
WO-2005018529-A2 PHENOXIACETIC ACID DERIVATIVES ASTRAZENECA AB (SE) 2005-03-03 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-20060293352-A1 Phenoxiacetic acid derivatives HRH2, HRH1, HCAR2 ALDH1A1 616/4885MEN1 3996/4885KMT2A 647/4885
US-20110281898-A1 PHENOXIACETIC ACID DERIVATIVES HIF1A, HPD, HIF1AN ALDH1A1 550/4885MEN1 3563/4885KMT2A 607/4885

“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.