SCHEMBL4091406

SCHEMBL4091406

O=C(Nc1ccc2[nH]ccc2c1)NC(c1ccc(C(=O)Nc2nn[nH]n2)cc1)c1ccc(C2CCCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
GCGR P47871 4/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
S1PR1 P21453 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
DEGS1 O15121 1/20 0.39
LMNA P02545 1/20 0.38
GIPR P48546 2/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ESR1 P03372 1/20 0.36
NAMPT P43490 1/20 0.36

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
SCHEMBL4086859 0.85 GCGR (0.43) GCGRS1PR1HDAC3HDAC11HDAC8
SCHEMBL4081953 0.84 GCGR (0.49) EPHX1GCGRHDAC3HDAC11HDAC8
SCHEMBL4091987 0.84 GCGR (0.44) GCGRHDAC3HDAC11HDAC8HDAC6
SCHEMBL4087662 0.83 GCGR (0.46) GCGRHDAC3HDAC11HDAC8HDAC6
SCHEMBL4081849 0.83 GCGR (0.44) GCGRNPC1RAB9AMAPTLMNA
SCHEMBL4092558 0.82 GCGR (0.44) EPHX1GCGRHDAC3HDAC11HDAC8
SCHEMBL4081872 0.82 GCGR (0.46) GCGRHDAC3HDAC11HDAC8HDAC6
SCHEMBL4086482 0.82 GCGR (0.44) GCGRHDAC3HDAC11HDAC8HDAC6
SCHEMBL4092326 0.82 LMNA (0.45) EPHX1GCGRHDAC3HDAC11HDAC8
SCHEMBL4092553 0.81 GCGR (0.42) EPHX1GCGRHDAC3HDAC11HDAC8

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
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

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 EPHX1 2751/4885GCGR 3/4885NPC1 1959/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR EPHX1 2751/4885GCGR 3/4885NPC1 1959/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR EPHX1 2751/4885GCGR 3/4885NPC1 1959/4885

“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.