SCHEMBL1443365

SCHEMBL1443365

O=C(O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.73
POLB P06746 2/20 0.73
CDC25B P30305 2/20 0.68
CDC25A P30304 1/20 0.68
HSD17B10 Q99714 1/20 0.68
NR4A1 P22736 1/20 0.66
SRD5A2 P31213 1/20 0.62
AKR1C3 P42330 3/20 0.60
TSHR P16473 1/20 0.60
ATM Q13315 1/20 0.58
SLC6A2 P23975 1/20 0.57
SLC6A4 P31645 1/20 0.57
SLC6A3 Q01959 1/20 0.57
ALOX15 P16050 1/20 0.56
KDM4E B2RXH2 1/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL31364358 1.00 ALDH1A1 (0.73) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL10727775 0.85 SLC6A2 (0.60) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL30912248 0.85 ALDH1A1 (0.77) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL11550449 0.85 ALDH1A1 (0.73) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL614963 0.85 ALDH1A1 (0.77) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL24703953 0.83 NR4A1 (0.58) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL31310077 0.81 ALDH1A1 (0.58) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL10442862 0.81 ALDH1A1 (0.58) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL29736650 0.81 ALDH1A1 (0.58) ALDH1A1POLBCDC25BCDC25AHSD17B10
SCHEMBL19334467 0.81 POLB (0.58) ALDH1A1POLBCDC25BCDC25AHSD17B10

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9650362-B2 Inhibitors PROBIODRUG AG (DE) 2017-05-16 US disclosed
US-20160039795-A1 NOVEL INHIBITORS VIVORYON THERAPEUTICS N.V. (DE) 2016-02-11 US disclosed
US-9173885-B2 Inhibitors PROBIODRUG AG (DE) 2015-11-03 US disclosed
EP-2475428-B1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2015-07-01 EP disclosed
US-20140065095-A1 NOVEL INHIBITORS VIVORYON THERAPEUTICS N.V. (DE) 2014-03-06 US disclosed
US-8486940-B2 Inhibitors PROBIODRUG AG (DE) 2013-07-16 US disclosed
EP-2475428-A1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE Probiodrug AG (DE) 2012-07-18 EP disclosed
US-20110092501-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-04-21 US disclosed
WO-2011029920-A1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2011-03-17 WO disclosed
US-20090253908-A1 NOVEL M3 MUSCARINIC ACETYLCHOINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED 2009-10-08 US disclosed
WO-2005087236-A1 NOVEL M3 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2005-09-22 WO disclosed
US-5624922-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1997-04-29 US disclosed
EP-0597540-B1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC (US) 1996-06-05 EP disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP disclosed
US-4322356-A Method of preparing substituted phthalides THE DOW CHEMICAL CO. (US) 1982-03-30 US disclosed
US-4188330-A Substituted phthalide derivatives THE DOW CHEMICAL COMPANY (US) 1980-02-12 US disclosed
US-4058529-A Polycyclic amino derivatives of pyrrolidone and piperidone CIBA-GEIGY CORPORATION (US) 1977-11-15 US disclosed
US-4036855-A Phthalides and process for preparing same SANDOZ, INC. (US) 1977-07-19 US disclosed
US-3943147-A Process for imidazo isoindoles SANDOZ, INC. (US) 1976-03-09 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 (4 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-20110092501-A1 NOVEL INHIBITORS GLUL, QPCT, GLS ALDH1A1 2195/4885POLB 1125/4885CDC25B 953/4885
US-20160039795-A1 NOVEL INHIBITORS GLUL, QPCT, GLS ALDH1A1 2195/4885POLB 1125/4885CDC25B 953/4885
US-20140065095-A1 NOVEL INHIBITORS GLUL, QPCT, GLS ALDH1A1 2195/4885POLB 1125/4885CDC25B 953/4885
US-20090253908-A1 NOVEL M3 MUSCARINIC ACETYLCHOINE RECEPTOR ANTAGONISTS CHRM3, CHRM2, CHRNA3 ALDH1A1 1423/4885POLB 4388/4885CDC25B 4530/4885

“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.