SCHEMBL4292313

SCHEMBL4292313

CCOC(=O)C1CC(=O)C(C(=O)c2ccc(C3CC3)cc2)=C(O)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.43
KMT2A Q03164 1/20 0.43
ESR2 Q92731 1/20 0.39
BUB1 O43683 1/20 0.38
GLA P06280 1/20 0.38
HSP90AA1 P07900 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C9 P11712 1/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.36
NPC1L1 Q9UHC9 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL4284354 0.88 ALDH1A1 (0.46) ALDH1A1KDM4EKMT2ABUB1GLA
SCHEMBL4285688 0.87 ALDH1A1 (0.40) ALDH1A1KDM4EKMT2AESR2HSP90AA1
SCHEMBL4281310 0.86 KDM4E (0.44) ALDH1A1KDM4EKMT2AESR2BUB1
SCHEMBL10337538 0.85 BUB1 (0.49) ALDH1A1KDM4EKMT2ABUB1MAPT
SCHEMBL4289348 0.85 POLB (0.46) ALDH1A1KDM4EKMT2ABUB1GLA
SCHEMBL10001994 0.76 ALDH1A1 (0.48) ALDH1A1KDM4EKMT2ABUB1MAPT
SCHEMBL4280973 0.75 ALDH1A1 (0.43) ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL4288123 0.75 LMNA (0.44) ALDH1A1KDM4EKMT2AHSP90AA1MAPK1
SCHEMBL24413554 0.74 ALDH1A1 (0.49) ALDH1A1KDM4EKMT2ABUB1MAPT
SCHEMBL29283290 0.73 KDM4E (0.45) ALDH1A1KDM4EKMT2AESR2GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137499-A1 BENZYLPHENYL GLUCOPYRANOSIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-05-28 US disclosed
EP-2048150-A1 BENZYL PHENYL GLUCOPYRANOSIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-04-15 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-20090137499-A1 BENZYLPHENYL GLUCOPYRANOSIDE DERIVATIVE SLC5A1, SLC5A2, SLC2A1 ALDH1A1 896/4885KDM4E 1987/4885KMT2A 1397/4885

“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.