SCHEMBL26967906

SCHEMBL26967906

COCCOc1cc(NC(=O)O)c(Br)nc1OC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.38
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 2/20 0.38
HPGD P15428 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
RECQL P46063 1/20 0.37
MAPT P10636 1/20 0.37
LRRK2 Q5S007 1/20 0.34
GRM4 Q14833 2/20 0.34
CYP2B6 P20813 1/20 0.33
TENT4A Q5XG87 1/20 0.33
TENT4B Q8NDF8 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL29157688 0.84 BRD4 (0.37) KDM4EALDH1A1L3MBTL1HTTHPGD
SCHEMBL30843850 0.84 BRD4 (0.37) KDM4EALDH1A1L3MBTL1HTTHPGD
SCHEMBL26967916 0.75 NPSR1 (0.40) KDM4EALDH1A1HTTHPGDKMT2A
SCHEMBL26967891 0.74 PDPK1 (0.36) L3MBTL1TSHR
SCHEMBL27200088 0.70 CYP2B6 (0.36) KDM4EALDH1A1L3MBTL1HPGDKMT2A
SCHEMBL21327178 0.69 CYP2B6 (0.38) KDM4EALDH1A1KMT2AUSP2CYP2B6
SCHEMBL31554523 0.68 AAK1 (0.40) KDM4EALDH1A1
SCHEMBL21327297 0.68 CYP2B6 (0.35) KDM4EKMT2AUSP2CYP2B6TENT4A
SCHEMBL28090675 0.68 HTT (0.52) KDM4EALDH1A1L3MBTL1HTTHPGD
SCHEMBL26617375 0.68 GRM4 (0.49) KDM4EALDH1A1HTTHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158393-A1 PYRIDONE COMPOUNDS AND METHODS OF USE EXELIXIS, INC. 2024-05-16 US disclosed
EP-4294804-A1 PYRIDONE COMPOUNDS AND METHODS OF USE Exelixis, Inc. (US) 2023-12-27 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 (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-20240158393-A1 PYRIDONE COMPOUNDS AND METHODS OF USE PDXK, PLK2, MAP4K2 KDM4E 2816/4885ALDH1A1 4282/4885L3MBTL1 3161/4885

“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.