SCHEMBL4091217

SCHEMBL4091217

COc1cc(CN(Cc2ccc(C(=O)NCCC(=O)O)cc2)C(=O)Nc2ccc(C)cc2)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.52
GCGR P47871 11/20 0.46
GLP1R P43220 2/20 0.46
GIPR P48546 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
CCR5 P51681 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ADCY6 O43306 1/20 0.43
ADCY3 O60266 1/20 0.43
ADCY9 O60503 1/20 0.43
ADCY5 O95622 1/20 0.43
ADCY8 P40145 1/20 0.43
ADCY7 P51828 1/20 0.43
ADCY2 Q08462 1/20 0.43
ADCY1 Q08828 1/20 0.43
ADCY4 Q8NFM4 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL4092102 0.86 CYP1A2 (0.47) SMN1; SMN2GAAGCGRMEN1KMT2A
SCHEMBL4091220 0.80 GCGR (0.44) GCGRMEN1KMT2AMAPTCCR5
SCHEMBL2663548 0.76 GCGR (0.56) GCGRGLP1RGIPR
SCHEMBL2663140 0.76 ALDH1A1 (0.51) SMN1; SMN2GAAALDH1A1TSHRHDAC1
SCHEMBL3206371 0.75 POLB (0.64) SMN1; SMN2GAAMEN1KMT2AALDH1A1
SCHEMBL5316658 0.74 EGFR (0.46) SMN1; SMN2GAAALDH1A1TSHR
SCHEMBL2663141 0.74 GCGR (0.56) GCGRGLP1RGIPRADCY6ADCY3
SCHEMBL2662997 0.73 GCGR (0.51) SMN1; SMN2GCGRGLP1RGIPRALDH1A1
SCHEMBL4087042 0.71 GCGR (0.63) GCGRGLP1RGIPRADCY6ADCY3
SCHEMBL2663065 0.71 GCGR (0.65) GCGRGLP1RGIPRADCY6ADCY3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-20030220350-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-11-27 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 US disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 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 (3 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-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR SMN1; SMN2 3528/4885GAA 484/4885GCGR 3/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR SMN1; SMN2 3528/4885GAA 484/4885GCGR 3/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR SMN1; SMN2 3528/4885GAA 484/4885GCGR 3/4885

“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.