SCHEMBL5607247

SCHEMBL5607247

N[C@@H](Cc1ccc(CNC(=O)c2cccc(OC(F)(F)F)c2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.61
MAPK14 Q16539 1/20 0.55
EPHX2 P34913 3/20 0.55
PPARG P37231 2/20 0.55
PPARA Q07869 2/20 0.55
GPR139 Q6DWJ6 1/20 0.51
ROCK2 O75116 1/20 0.50
ROCK1 Q13464 1/20 0.50
CHRM3 P20309 1/20 0.50
PTPN1 P18031 1/20 0.49
NR1H4 Q96RI1 1/20 0.48
SLC7A5 Q01650 3/20 0.48
DDR1 Q08345 2/20 0.48
GPR132 Q9UNW8 1/20 0.47
AKR1C3 P42330 1/20 0.46
NAMPT P43490 1/20 0.46

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
SCHEMBL5607255 1.00 HTR2C (0.61) HTR2CMAPK14EPHX2PPARGPPARA
SCHEMBL5607751 0.85 MMP13 (0.63) PPARGSLC7A5
SCHEMBL5607748 0.85 MMP13 (0.63) PPARGSLC7A5
SCHEMBL5607869 0.83 SMN1; SMN2 (0.56) EPHX2PPARGPPARAROCK2ROCK1
SCHEMBL5607860 0.83 SMN1; SMN2 (0.56) EPHX2PPARGPPARAROCK2ROCK1
SCHEMBL5608057 0.83 LMNA (0.56) MAPK14EPHX2PPARGPPARASLC7A5
SCHEMBL5608062 0.83 LMNA (0.56) MAPK14EPHX2PPARGPPARASLC7A5
SCHEMBL5607609 0.82 MEN1 (0.59) EPHX2PPARGGPR139NR1H4SLC7A5
SCHEMBL5607599 0.82 MEN1 (0.59) EPHX2PPARGGPR139NR1H4SLC7A5
SCHEMBL8233853 0.80 MMP13 (0.46) EPHX2PPARGPPARANR1H4SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101400699-A Human glucagon-like-peptide-1 modulators and their use in the treatment of diabetes and related conditions BRISTOL MYERS SQUIBB CO (US) 2009-04-01 CN claimed
US-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 US claimed
CN-101400699-A Human glucagon-like-peptide-1 modulators and their use in the treatment of diabetes and related conditions BRISTOL MYERS SQUIBB CO (US) 2009-04-01 CN disclosed
US-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 US disclosed
US-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 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 (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-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS GLP1R, GIPR, IAPP HTR2C 2261/4885MAPK14 2587/4885EPHX2 3665/4885

“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.