SCHEMBL5607245

SCHEMBL5607245

COc1ccc(C(=O)NCc2ccc(C[C@H](N)C(=O)O)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.72
NPC1 O15118 4/20 0.64
RAB9A P51151 3/20 0.64
ALDH1A1 P00352 2/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
EPHX2 P34913 4/20 0.62
KMT2A Q03164 2/20 0.62
MEN1 O00255 1/20 0.62
NR1H4 Q96RI1 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
PPARA Q07869 2/20 0.56
TSHR P16473 1/20 0.56
TPH1 P17752 2/20 0.55
CXCR3 P49682 1/20 0.53
LDHA P00338 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
ALOX12 P18054 1/20 0.52
CYP2C19 P33261 1/20 0.52

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
SCHEMBL5607252 1.00 PPARG (0.72) PPARGNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5607223 0.89 SMN1; SMN2 (0.58) PPARGNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5607240 0.89 SMN1; SMN2 (0.58) PPARGNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5607751 0.85 MMP13 (0.63) PPARGNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5607748 0.85 MMP13 (0.63) PPARGNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5608468 0.85 ALDH1A1 (0.58) PPARGALDH1A1SMN1; SMN2EPHX2KMT2A
SCHEMBL5080197 0.85 ALDH1A1 (0.58) PPARGALDH1A1SMN1; SMN2EPHX2KMT2A
SCHEMBL21690447 0.85 PPARG (0.67) PPARGRAB9AEPHX2NR1H4PPARA
SCHEMBL9416606 0.85 NPC1 (0.82) PPARGNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL126195 0.85 LDHA (0.71) PPARGPPARATPH1LDHACYP1A2

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 6 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
WO-2007082264-A2 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-19 WO 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 PPARG 250/4885NPC1 2647/4885RAB9A 1699/4885

“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.