SCHEMBL3189642

SCHEMBL3189642

CCOC(=O)c1c(C)[nH]c(C)cc1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
KDM4E B2RXH2 4/20 0.59
HPGD P15428 2/20 0.53
MAPK1 P28482 2/20 0.52
POLB P06746 2/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 8/20 0.50
GAA P10253 3/20 0.50
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KMT2A Q03164 4/20 0.49
PKM P14618 1/20 0.48
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 2/20 0.47
ATM Q13315 2/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL26608435 0.85 KDM4E (0.62) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL15760924 0.83 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL9454931 0.83 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL9455203 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDPOLBHSD17B10
SCHEMBL23146953 0.82 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL9454685 0.81 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL9454556 0.81 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL9454856 0.79 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL68410 0.77 SMN1; SMN2 (0.71) ALDH1A1KDM4EHPGDMAPK1POLB
SCHEMBL10747580 0.77 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDMAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors TORRENT PHARMACEUTICALS LTD. (IN) 2010-01-14 US disclosed
CN-101437818-A Novel Dual Acting Receptor Antagonists (DARA) for AT1 and ETA receptors TORRENT PHARMACEUTICALS LTD (IN) 2009-05-20 CN disclosed
EP-1996588-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS Torrent Pharmaceuticals Ltd (IN) 2008-12-03 EP disclosed
US-7271153-B2 Treating diseases associated with hyperglycemia such as diabetes; SGLT2 (sodium/glucose cotransporter 2) inhibitor; 3-(4-Ethylbenzyl)-2-(beta-D-glucopyranosyloxy)-4,6-dimethyl-pyridine for example KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-09-18 US disclosed
WO-2007100295-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS TORRENT PHARMACEUTICALS LTD (IN) 2007-09-07 WO disclosed
US-20050049203-A1 Nitrogenous heterocyclic derivative, medicinal composition containing the same, medical use thereof, and intermediate therefor KISSEI PHARMACEUTICAL CO., LTD. (JP) 2005-03-03 US disclosed
EP-1405859-A1 NITROGENOUS HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF AND INTERMEDIATE THEREFOR Kissei Pharmaceutical Co., Ltd. (JP) 2004-04-07 EP disclosed
US-5399566-A Hypotensive MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-03-21 US disclosed
US-5380730-A Angiotensin antagonist IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-01-10 US disclosed
US-5236936-A Treating hypertension, congestive heart failure IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-17 US disclosed
US-5198439-A Hypotensive agents, congestive heart failure IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-03-30 US disclosed
EP-0499416-A2 Pyridine compounds as angiotensin II antagonists, processes for their preparation and pharmaceutical compositions containing them ZENECA LIMITED (GB) 1992-08-19 EP disclosed
US-5130318-A Hypotensive agents and for treatment of congestive heart failure IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-14 US disclosed
EP-0487745-A1 PYRIDINE DERIVATIVE WITH ANGIOTENSIN II ANTAGONISM MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-06-03 EP disclosed
EP-0453210-A2 Pyridine derivatives ZENECA LIMITED (GB) 1991-10-23 EP 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-20050049203-A1 Nitrogenous heterocyclic derivative, medicinal composition containing the same, medical use thereof, and intermediate therefor GPR119, NPR3, SLC5A2 ALDH1A1 2064/4885KDM4E 4219/4885HPGD 242/4885
US-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors EDNRA, EDNRB, AGTR1 ALDH1A1 892/4885KDM4E 3045/4885HPGD 2587/4885

“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.