SCHEMBL2663137

SCHEMBL2663137

O=C(O)CCNC(=O)c1ccc(CN(CCc2ccccc2)Cc2ccc(Oc3ccccc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.54
SRD5A2 P31213 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
FFAR1 O14842 1/20 0.52
HPGD P15428 1/20 0.52
OPRK1 P41145 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MMP2 P08253 1/20 0.50
CA9 Q16790 1/20 0.50
MCHR1 Q99705 1/20 0.50
SIGMAR1 Q99720 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TMEM97 Q5BJF2 2/20 0.49
HDAC1 Q13547 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL4091423 0.84 ACKR3 (0.52) ACHESRD5A2FFAR1NPC1RAB9A
SCHEMBL28929666 0.84 CA1 (0.67) SRD5A2MEN1KMT2AHPGDCA12
SCHEMBL22987223 0.77 HPGD (0.74) SRD5A2FFAR1HPGDNPC1RAB9A
SCHEMBL7741050 0.76 MAPK1 (0.64) HPGDCA12CA1CA2MMP2
SCHEMBL2653208 0.76 GCGR (0.50) HPGDCA12CA1CA2MMP2
SCHEMBL2661398 0.75 GCGR (0.51) MCHR1HDAC1
SCHEMBL27600901 0.74 MEN1 (0.65) MEN1KMT2AHPGDCA12CA1
SCHEMBL10621481 0.74 TMEM97 (0.59) OPRK1SIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL1122952 0.74 LPAR1 (0.53) FFAR1HDAC1LPAR1LPAR5
SCHEMBL2657107 0.74 S1PR1 (0.66) MEN1KMT2AFFAR1HPGDNPC1

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 10 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
CN-1356977-A Glucagon antagonists/inverse agonists NOVO NORDISK AS (DK) 2002-07-03 CN 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 ACHE 3981/4885SRD5A2 1656/4885MEN1 2079/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR ACHE 3981/4885SRD5A2 1656/4885MEN1 2079/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR ACHE 3981/4885SRD5A2 1656/4885MEN1 2079/4885

“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.