SCHEMBL4848402

SCHEMBL4848402

CCOC(=O)Cc1ccc(-c2nc(COc3cc(C(=O)OC)on3)c(C)o2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.43
FFAR1 O14842 1/20 0.42
MAPT P10636 5/20 0.41
PPARG P37231 3/20 0.41
PPARA Q07869 3/20 0.41
TP53 P04637 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
THRB P10828 1/20 0.40
TARBP2 Q15633 1/20 0.40
PDCD4 Q53EL6 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL4029491 0.85 FFAR1 (0.54) FFAR1MAPTPPARGPPARATP53
SCHEMBL4035439 0.77 PPARG (0.56) PPARGPPARA
SCHEMBL7487642 0.76 FFAR1 (0.57) FFAR1MAPTPPARGPPARA
SCHEMBL4845837 0.76 FFAR1 (0.50) FFAR1MAPTPPARGPPARA
SCHEMBL4124767 0.73 SMPD1 (0.44) HSD17B10SMN1; SMN2POLB
SCHEMBL4029981 0.71 KDR (0.61) FFAR1MAPTPPARGPPARA
SCHEMBL19697549 0.71 KDM4E (0.54) HSD17B10FFAR1MAPTPPARGPPARA
SCHEMBL6156630 0.71 FFAR1 (0.71) FFAR1MAPTPPARGPPARATP53
SCHEMBL7896956 0.70 SMPD1 (0.50) MAPTTP53SMN1; SMN2KMT2APOLB
SCHEMBL4034286 0.69 FFAR1 (0.69) FFAR1MAPTPPARGPPARATP53

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 HSD17B10 23/4885FFAR1 771/4885MAPT 4700/4885

“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.