SCHEMBL2906818

SCHEMBL2906818

Cc1cc(O)ccc1-c1cccc(C=O)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 9/20 0.46
ESR1 P03372 8/20 0.46
HSD17B1 P14061 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
KCNJ1 P48048 1/20 0.40
ANPEP P15144 1/20 0.39
DPP4 P27487 1/20 0.39
ERN1 O75460 2/20 0.38
TYR P14679 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
ALOX12 P18054 1/20 0.37
MAPK10 P53779 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
TLR2 O60603 1/20 0.37
TLR1 Q15399 1/20 0.37
TLR6 Q9Y2C9 1/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL562872 0.82 ALDH1A1 (0.41) ESR2ESR1ALDH1A1TSHRKCNJ1
SCHEMBL13139867 0.81 ALDH1A1 (0.42) ALDH1A1TSHRKCNJ1ERN1TYR
SCHEMBL19897782 0.80 ALDH1A1 (0.52) ALDH1A1TSHRKCNJ1ERN1MEN1
SCHEMBL30395616 0.80 ALDH1A1 (0.52) ALDH1A1TSHRKCNJ1ERN1MEN1
SCHEMBL8373514 0.79 ESR2 (0.55) ESR2ESR1HSD17B1ALDH1A1ANPEP
SCHEMBL3932855 0.79 ALDH1A1 (0.59) ALDH1A1TSHRKCNJ1ERN1MEN1
SCHEMBL30340593 0.79 ALDH1A1 (0.59) ALDH1A1TSHRKCNJ1ERN1MEN1
SCHEMBL13140085 0.78 ERN1 (0.46) ESR2ESR1ALDH1A1TSHRKCNJ1
SCHEMBL25424114 0.78 ERN1 (0.53) ALDH1A1TSHRKCNJ1ERN1MEN1
SCHEMBL31051635 0.78 ERN1 (0.53) ALDH1A1TSHRKCNJ1ERN1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267775-A1 OXADIAZOLIDINEDIONE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-21 US disclosed
US-20100267775-A1 OXADIAZOLIDINEDIONE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-21 US disclosed
US-20100267775-A1 OXADIAZOLIDINEDIONE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-21 US disclosed
EP-2216330-A1 OXADIAZOLIDINEDIONE COMPOUND Astellas Pharma Inc. (JP) 2010-08-11 EP disclosed
EP-2216330-A1 OXADIAZOLIDINEDIONE COMPOUND Astellas Pharma Inc. (JP) 2010-08-11 EP disclosed
US-7732626-B2 Fused cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-08 US disclosed
US-20100004312-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 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 (2 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-20100004312-A1 FUSED CYCLIC COMPOUNDS GPR119, GLP1R, GPR65 ESR2 612/4885ESR1 274/4885HSD17B1 282/4885
US-20100267775-A1 OXADIAZOLIDINEDIONE COMPOUND GPR119, GLP1R, GPR4 ESR2 1033/4885ESR1 299/4885HSD17B1 404/4885

“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.