SCHEMBL4665263

SCHEMBL4665263

O=C(O)c1ccc(=O)n(CCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.51
BRD2 P25440 1/20 0.51
BRD3 Q15059 1/20 0.51
BRDT Q58F21 1/20 0.51
KDM4E B2RXH2 2/20 0.48
PARK7 Q99497 1/20 0.48
DAO P14920 2/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 1/20 0.44
KDM6B O15054 1/20 0.44
KDM4A O75164 1/20 0.44
KDM5C P41229 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
KDM2A Q9Y2K7 1/20 0.44
KDM3A Q9Y4C1 1/20 0.44
PPARA Q07869 1/20 0.43
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL1617368 0.83 BRD4 (0.70) BRD4BRD2BRD3BRDTKDM4E
SCHEMBL14007194 0.81 BRD4 (0.55) BRD4BRD2BRD3BRDTKDM4E
SCHEMBL4251833 0.80 BRD4 (0.42) BRD4BRD2BRD3BRDTKDM4E
SCHEMBL3161296 0.78 L3MBTL1 (0.45) BRD4BRD2BRD3BRDTKDM4E
SCHEMBL4917682 0.77 PKM (0.57) KDM4EMEN1KMT2AKDM6BKDM5C
SCHEMBL28148357 0.77 ALKBH1 (0.51) KDM4EPARK7DAOKDM6BKDM4A
SCHEMBL16474466 0.77 ALDH1A1 (0.53) KDM4EDAOMEN1KMT2AALDH1A1
SCHEMBL14007247 0.77 EPHX2 (0.70) BRD4BRD2BRD3BRDTMEN1
SCHEMBL27795662 0.75 HCAR3 (0.43) BRD4BRD2BRD3BRDTKDM4E
SCHEMBL7229327 0.75 BRD4 (0.59) BRD4BRD2BRD3BRDTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280904-A1 N-Substituted Pyridinone or Pyrimidinone Compounds Useful as Soluble Epoxide Hydrolase Inhibitors ELDRUP ANNE BETTINA 2008-11-13 US disclosed
EP-1934182-A1 N-SUBSTITUTED PYRIDINONE OR PYRIMIDINONE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-06-25 EP disclosed
WO-2007044491-A1 N-SUBSTITUTED PYRIDINONE OR PYRIMIDINONE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-04-19 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 (1 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-20080280904-A1 N-Substituted Pyridinone or Pyrimidinone Compounds Useful as Soluble Epoxide Hydrolase Inhibitors EPHX1, EPHX2, DOHH BRD4 2988/4885BRD2 3385/4885BRD3 3422/4885

“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.