SCHEMBL4845917

SCHEMBL4845917

Cc1oc(-c2ccco2)nc1COc1ccc(CO)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.49
KDR P35968 1/20 0.47
ANO1 Q5XXA6 1/20 0.44
PPARA Q07869 3/20 0.43
SMN1; SMN2 Q16637 6/20 0.41
HPGD P15428 5/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 6/20 0.41
HSD17B10 Q99714 4/20 0.41
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41
XBP1 P17861 1/20 0.41
LMNA P02545 5/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TSHR P16473 3/20 0.39
KDM4E B2RXH2 3/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 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
SCHEMBL4848828 0.91 PPARG (0.50) PPARGKDRANO1PPARASMN1; SMN2
SCHEMBL4851038 0.88 PPARG (0.50) PPARGKDRANO1PPARASMN1; SMN2
SCHEMBL4850848 0.88 PPARG (0.58) PPARGKDRANO1PPARASMN1; SMN2
SCHEMBL4035637 0.88 PPARG (0.62) PPARGKDRANO1PPARASMN1; SMN2
SCHEMBL4845337 0.87 PPARG (0.53) PPARGKDRANO1PPARASMN1; SMN2
SCHEMBL4845981 0.85 PPARG (0.53) PPARGKDRANO1PPARASMN1; SMN2
SCHEMBL4850953 0.83 PPARG (0.50) PPARGKDRPPARASMN1; SMN2HPGD
SCHEMBL4034983 0.82 KDR (0.53) PPARGKDRPPARASMN1; SMN2HPGD
SCHEMBL4850977 0.82 KDR (0.71) PPARGKDRPPARAFFAR1
SCHEMBL4850393 0.82 PPARG (0.40) PPARGKDRANO1PPARASMN1; SMN2

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 536/4885KDR 2335/4885ANO1 2735/4885

“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.