SCHEMBL4092103

SCHEMBL4092103

COc1cc(CC(NC(=O)Nc2ccc3c(c2)OCO3)c2ccc(C(=O)NCCC(=O)O)cc2)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
GAA P10253 1/20 0.47
ATM Q13315 1/20 0.47
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
RAB9A P51151 6/20 0.44
NPC1 O15118 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TP53 P04637 2/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
FPR1 P21462 1/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL4091220 0.86 GCGR (0.44) MAPTMEN1KMT2A
SCHEMBL4092102 0.82 CYP1A2 (0.47) MAPTGAAATMCYP1A2CYP3A4
SCHEMBL4087843 0.77 NAMPT (0.43) MAPTCYP1A2CYP3A4RAB9ANPC1
SCHEMBL2663140 0.70 ALDH1A1 (0.51) GAACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL3206371 0.69 POLB (0.64) GAACYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL31313264 0.69 PKM (0.67) CYP1A2CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL4085798 0.69 GCGR (0.57)
SCHEMBL4086328 0.68 GCGR (0.65)
SCHEMBL2662006 0.68 ALDH1A1 (0.52) MAPTGAARAB9ANPC1SMN1; SMN2
SCHEMBL4087049 0.67 GCGR (0.59) CYP3A4

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
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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR MAPT 4379/4885GAA 484/4885ATM 3575/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR MAPT 4379/4885GAA 484/4885ATM 3575/4885

“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.