SCHEMBL3619403

SCHEMBL3619403

O=C(O)Nc1ccccc1OCc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.77
TDP1 Q9NUW8 2/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
PPIA P62937 5/20 0.59
SGMS2 Q8NHU3 3/20 0.56
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
GAA P10253 1/20 0.52
POLB P06746 1/20 0.52
NPC1 O15118 2/20 0.50
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
RAB9A P51151 1/20 0.50
ALPG P10696 1/20 0.50
PTK2B Q14289 1/20 0.50

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
SCHEMBL4297414 0.88 BRD4 (0.74) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL26669004 0.87 BRD4 (0.60) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL8924076 0.87 BRD4 (1.00) BRD4TDP1L3MBTL1PPIARAB9A
SCHEMBL11549645 0.85 BRD4 (0.70) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL38660185 0.85 BRD4 (0.70) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL7298832 0.85 BRD4 (0.70) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL5174575 0.84 BRD4 (0.68) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL21810510 0.84 PPIA (0.76) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL13652590 0.84 BRD4 (0.73) BRD4TDP1L3MBTL1PPIASGMS2
SCHEMBL7935581 0.84 BRD4 (0.68) BRD4TDP1L3MBTL1PPIASGMS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1349858-B1 AGENTS USEFUL FOR REDUCING AMYLOID PRECURSOR PROTEIN AND TREATING DEMANTIA AND METHODS OF USE THEREOF US GOV HEALTH & HUMAN SERV (US) 2008-08-27 EP claimed
US-7153882-B2 Agents useful for reducing amyloid precursor protein and treating demantia and methods of use thereof THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-12-26 US claimed
US-9487507-B2 TRPV4 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2016-11-08 US disclosed
EP-2720546-B1 SPIRO-CYCLIC TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-04-06 EP disclosed
US-20140113916-A1 TRPV4 ANTAGONISTS GlaxoSmithKline, LLC (US) 2014-04-24 US disclosed
EP-2720546-A1 TRPV4 ANTAGONISTS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2014-04-23 EP disclosed
WO-2012174342-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2012-12-20 WO disclosed
US-20100099690-A1 XANTHINE DERIVATIVES AS SELECTIVE HM74A AGONISTS SMITHKLINE BEECHAM CORPORATION 2010-04-22 US disclosed
EP-1912993-A1 XANTHINE DERIVATIVES AS SELECTIVE HM74A AGONISTS SmithKline Beecham Corporation (US) 2008-04-23 EP disclosed
WO-2007017265-A1 XANTHINE DERIVATIVES AS SELECTIVE HM74A AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO disclosed
EP-0525197-B1 3-BENZYLIDENE-1-CARBAMOYL-2-PYRROLIDONE ANALOGS SHIONOGI & CO (JP) 1997-08-27 EP disclosed
US-5319100-A Antiinflammatory agent which does not cause stomach diseases SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1994-06-07 US disclosed
US-5319099-A Antiinflammatory agent which does not cause stomach diseases SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1994-06-07 US disclosed
EP-0525197-A1 3-BENZYLIDENE-1-CARBAMOYL-2-PYRROLIDONE ANALOG SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1993-02-03 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-20140113916-A1 TRPV4 ANTAGONISTS TRPV4, TRPV3, TRPV5 BRD4 343/4885TDP1 4249/4885L3MBTL1 4181/4885
US-20100099690-A1 XANTHINE DERIVATIVES AS SELECTIVE HM74A AGONISTS GPR84, GPR88, HCAR1 BRD4 3083/4885TDP1 966/4885L3MBTL1 3204/4885

“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.