SCHEMBL3851704

SCHEMBL3851704

O=c1[nH]c2cnccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 8/20 0.57
PDE3A Q14432 8/20 0.57
CMA1 P23946 1/20 0.47
PARP1 P09874 2/20 0.41
KDM5A P29375 2/20 0.40
DAO P14920 2/20 0.40
KDM5C P41229 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
IKBKB O14920 1/20 0.37
AURKA O14965 1/20 0.37
CHUK O15111 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PIM1 P11309 1/20 0.37
TOP1 P11387 1/20 0.37
GABRA1 P14867 1/20 0.37
IDO1 P14902 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL12433112 0.84 PDE3B (0.59) PDE3BPDE3ACMA1PARP1KDM5A
SCHEMBL14880785 0.76 PSMB8 (0.53) PDE3BPDE3AKDM4EGABRPGABRD
SCHEMBL26463638 0.70 PDE3B (0.62) PDE3BPDE3APGR
SCHEMBL83411 0.70 CMA1 (0.59) PDE3BPDE3ACMA1KDM4EALDH1A1
SCHEMBL29667911 0.70 CMA1 (0.59) PDE3BPDE3ACMA1KDM4EALDH1A1
SCHEMBL6909727 0.70 PDE3B (0.68) PDE3BPDE3AALDH1A1CYP2A6PGR
Bromide SCHEMBL9589695 0.68 CMA1 (0.57) PDE3BPDE3ACMA1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL4566776 0.68 CMA1 (0.57) PDE3BPDE3ACMA1KDM4EALDH1A1
SCHEMBL4622486 0.68 CMA1 (0.57) PDE3BPDE3ACMA1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL27353717 0.68 CMA1 (0.57) PDE3BPDE3ACMA1KDM4EALDH1A1

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-8957219-B2 Acetic acid amide derivative having inhibitory activity on endothelial lipase SHIONOGI & CO., LTD. (JP) 2015-02-17 US disclosed
EP-2351744-B1 ACETIC ACID AMIDE DERIVATIVE HAVING INHIBITORY ACTIVITY ON VASCULAR ENDOTHELIAL LIPASE SHIONOGI & CO (JP) 2015-01-07 EP disclosed
US-20140288302-A1 ACETIC ACID AMIDE DERIVATIVE HAVING INHIBITORY ACTIVITY ON ENDOTHELIAL LIPASE SHIONOGI & CO., LTD. (JP) 2014-09-25 US disclosed
US-8420052-B2 Imaging agents useful for identifying AD pathology SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2013-04-16 US disclosed
US-8420052-B2 Imaging agents useful for identifying AD pathology SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2013-04-16 US disclosed
EP-2351744-A1 ACETIC ACID AMIDE DERIVATIVE HAVING INHIBITORY ACTIVITY ON VASCULAR ENDOTHELIAL LIPASE Shionogi & Co., Ltd. (JP) 2011-08-03 EP disclosed
US-20100098634-A1 Imaging Agents Useful for Identifying AD Pathology SIEMENS MEDICAL SOLUTIONS USA, INC. 2010-04-22 US disclosed
US-20100098634-A1 Imaging Agents Useful for Identifying AD Pathology SIEMENS MEDICAL SOLUTIONS USA, INC. 2010-04-22 US disclosed
WO-2010011964-A2 IMAGING AGENTS USEFUL FOR IDENTIFYING AD PATHOLOGY SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2010-01-28 WO disclosed
EP-1824482-A4 3, 5-DISUBSTITUTED AND 3,5,7-TRISUBSTITUTED-3H-OXAZOLO AND 3H-THIAZOLO [4,5-d]PYRIMIDIN-2-ONE COMPOUNDS AND PRODRUGS THEREOF ANADYS PHARMACEUTICALS INC (US) 2009-08-26 EP disclosed
EP-1824482-A1 3, 5-DISUBSTITUTED AND 3,5,7-TRISUBSTITUTED-3H-OXAZOLO AND 3H-THIAZOLO [4,5-d]PYRIMIDIN-2-ONE COMPOUNDS AND PRODRUGS THEREOF Anadys Pharmaceuticals, Inc. (US) 2007-08-29 EP disclosed
WO-2006066080-A1 3, 5-DISUBSTITUTED AND 3,5,7-TRISUBSTITUTED-3H-OXAZOLO AND 3H-THIAZOLO [4,5-d]PYRIMIDIN-2-ONE COMPOUNDS AND PRODRUGS THEREOF ANADYS PHARMACEUTICALS, INC. (US) 2006-06-22 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-20100098634-A1 Imaging Agents Useful for Identifying AD Pathology APP, APBA1, PYGB PDE3B 370/4885PDE3A 287/4885CMA1 3831/4885
US-20140288302-A1 ACETIC ACID AMIDE DERIVATIVE HAVING INHIBITORY ACTIVITY ON ENDOTHELIAL LIPASE LIPG, CEL, FFAR3 PDE3B 355/4885PDE3A 447/4885CMA1 163/4885

“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.