SCHEMBL2519409

SCHEMBL2519409

Oc1ccc(CN(Cc2ccc(O)c3ncccc23)OCc2ccccc2)c2cccnc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.68
L3MBTL1 Q9Y468 8/20 0.68
NPC1 O15118 6/20 0.67
HTT P42858 5/20 0.67
RAB9A P51151 4/20 0.67
TP53 P04637 3/20 0.67
LMNA P02545 3/20 0.67
MAPT P10636 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
ALDH1A1 P00352 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
POLB P06746 1/20 0.67
TSHR P16473 1/20 0.67
MAPK1 P28482 1/20 0.67
PAX8 Q06710 1/20 0.63
ALOX15 P16050 3/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57
HIF1A Q16665 1/20 0.57
ALOX12 P18054 2/20 0.56

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
SCHEMBL2516006 0.81 PAX8 (0.69) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL2519523 0.81 PAX8 (0.69) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL17223772 0.81 KDM4E (1.00) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL1520610 0.78 PAX8 (1.00) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL2519345 0.77 KDM4E (0.72) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL1520091 0.76 KDM4E (1.00) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL2582932 0.74 PAX8 (0.58) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL114858 0.73 MAOA (0.55) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL2514842 0.73 ALOX15 (1.00) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL5594514 0.72 KDM4E (0.64) KDM4EL3MBTL1NPC1HTTRAB9A

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
EP-2382193-A1 PPAR AGONIST COMPOSITIONS AND METHODS OF USE Biopharmed (FR) 2011-11-02 EP disclosed
US-20110251238-A1 PPAR AGONIST COMPOSITIONS AND METHODS OF USE BIOPHARMED (FR) 2011-10-13 US disclosed
WO-2010073235-A1 PPAR AGONIST COMPOSITIONS AND METHODS OF USE BIOPHARMED (FR) 2010-07-01 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-20110251238-A1 PPAR AGONIST COMPOSITIONS AND METHODS OF USE PPARA, PPARG, PPARD KDM4E 4239/4885L3MBTL1 4433/4885NPC1 675/4885

“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.