SCHEMBL4844166

SCHEMBL4844166

COC(=O)c1cc(-c2nc(COc3ccc(CCl)cc3OC)c(C)o2)ccc1C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
USP2 O75604 1/20 0.42
MAPK1 P28482 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
SCHEMBL4853675 0.92 KDR (0.46) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL4850580 0.89 SMN1; SMN2 (0.43) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL4852529 0.85 SMN1; SMN2 (0.47) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL4852206 0.85 ALDH1A1 (0.52) PPARGPPARAKMT2AMAPTSMN1; SMN2
SCHEMBL4850642 0.83 PPARG (0.52) PPARGPPARAKMT2AMAPTSMN1; SMN2
SCHEMBL4851280 0.82 PPARG (0.46) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL4854184 0.81 SMN1; SMN2 (0.43) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL1731684 0.80 KDR (0.53) PPARGPPARAMAPTSMN1; SMN2LMNA
SCHEMBL4846412 0.80 FFAR1 (0.48) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL1732533 0.80 KDM4E (0.49) PPARGPPARAKMT2AMEN1MAPT

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-7368578-B2 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-06 US disclosed
US-20060135578-A1 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-22 US disclosed
EP-1541564-A1 FIVE-MEMBERED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2005-06-15 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-20060135578-A1 Five-membered heterocyclic compounds GPR119, OR10J3, CYP11B1 PPARG 536/4885PPARA 519/4885KMT2A 1792/4885

“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.