SCHEMBL4279587

SCHEMBL4279587

OCc1ccc(Cc2ccc(OC(F)(F)F)cc2)c(O)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.47
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
MPO P05164 1/20 0.42
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
TTR P02766 1/20 0.40
ALOX5 P09917 2/20 0.39
NLRP3 Q96P20 1/20 0.39
SLC5A1 P13866 2/20 0.38
SLC5A2 P31639 2/20 0.38
CHRM1 P11229 1/20 0.37
BCL2L1 Q07817 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
SCHEMBL508667 0.80 SLC6A4 (0.49) SLC6A4CYP11B1CYP11B2MAPTGPR84
SCHEMBL4289203 0.80 MAPT (0.53) MAPTMEN1KMT2ARAB9ATTR
SCHEMBL4288460 0.80 SLC6A4 (0.43) SLC6A4CYP11B1CYP11B2GPR84NLRP3
SCHEMBL4293661 0.80 ESR1 (0.49) MAPTMEN1KMT2ATTRSLC5A1
SCHEMBL2575166 0.80 SLC6A4 (0.61) SLC6A4CYP11B1CYP11B2MPOMAPT
SCHEMBL4282537 0.79 MAPT (0.49) MAPTMEN1KMT2AHTTTTR
SCHEMBL963834 0.78 PPARG (0.53) SLC6A4MAPTGPR84
SCHEMBL4292350 0.77 SLC5A2 (0.48) MAPTMEN1KMT2ASLC5A1SLC5A2
SCHEMBL1747062 0.77 LTA4H (0.59) SLC6A4MAPTGPR84
SCHEMBL2092054 0.74 SLC6A4 (0.56) SLC6A4CYP11B1CYP11B2MPOMAPT

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
CN-101472937-A Benzylphenylglucopyranoside Derivatives DAIICHI SANKYO CO LTD (JP) 2009-07-01 CN disclosed
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 SLC6A4 61/4885CYP11B1 737/4885CYP11B2 899/4885

“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.