SCHEMBL6539397

SCHEMBL6539397

COc1ccc(-c2nc(C(=O)N(C)OC)oc2-c2ccc(OC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 4/20 0.44
RXRA P19793 2/20 0.44
RXRB P28702 2/20 0.44
RXRG P48443 1/20 0.42
PPARD Q03181 5/20 0.42
GPBAR1 Q8TDU6 1/20 0.41
CLK1 P49759 1/20 0.41
DYRK1A Q13627 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
KDM4E B2RXH2 3/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 2/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TARBP2 Q15633 1/20 0.39
PDCD4 Q53EL6 1/20 0.39
CNR1 P21554 2/20 0.39

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
SCHEMBL6235969 0.87 PPARD (0.47) NR4A2RXRARXRBPPARDKDM4E
SCHEMBL6539723 0.87 PPARD (0.47) NR4A2RXRARXRBPPARDKDM4E
SCHEMBL6539626 0.82 NR4A2 (0.50) NR4A2RXRARXRBRXRGPPARD
SCHEMBL6539080 0.81 IKBKB (0.51) NR4A2RXRARXRBRXRGPPARD
SCHEMBL6538835 0.79 ESR2 (0.45) NR4A2RXRARXRBPPARDKDM4E
SCHEMBL6538971 0.79 PPARD (0.40) NR4A2RXRARXRBPPARD
SCHEMBL6232912 0.77 MEN1 (0.48) PPARDKDM4EMAPTHPGDLMNA
SCHEMBL6539837 0.77 HPGD (0.42) PPARDKDM4ETDP1MAPTHPGD
SCHEMBL6231751 0.76 IKBKB (0.47) NR4A2RXRARXRBRXRGPPARD
SCHEMBL6538826 0.76 NR4A2 (0.55) NR4A2RXRARXRBRXRGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040157891-A1 Inhibitor of cox FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US 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-20040157891-A1 Inhibitor of cox PTGS1, PTGS2, PTGES2 NR4A2 883/4885RXRA 1352/4885RXRB 1507/4885

“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.