SCHEMBL4096367

SCHEMBL4096367

COC(=O)c1ccc(C(NC(=O)Nc2ccc(OC(F)(F)F)cc2)C2CCC(C(C)(C)C)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.53
FAAH O00519 3/20 0.53
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
TRPV1 Q8NER1 1/20 0.46
PDE2A O00408 4/20 0.45
GCGR P47871 3/20 0.45
EPHX1 P07099 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
ADCY6 O43306 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
SCHEMBL4096368 1.00 EPHX2 (0.53) EPHX2FAAHALDH1A1HPGDTRPV1
SCHEMBL4096553 1.00 EPHX2 (0.53) EPHX2FAAHALDH1A1HPGDTRPV1
SCHEMBL2659919 0.92 EPHX2 (0.54) EPHX2FAAHALDH1A1HPGDTRPV1
SCHEMBL2659918 0.92 EPHX2 (0.54) EPHX2FAAHALDH1A1HPGDTRPV1
SCHEMBL4091871 0.92 EPHX2 (0.54) EPHX2FAAHALDH1A1HPGDTRPV1
SCHEMBL2653712 0.89 EPHX2 (0.53) EPHX2FAAHALDH1A1HPGDTRPV1
SCHEMBL6191013 0.87 GCGR (0.63) EPHX2FAAHTRPV1PDE2AGCGR
SCHEMBL4091936 0.86 GCGR (0.54) EPHX2FAAHTRPV1PDE2AGCGR
SCHEMBL4091939 0.86 GCGR (0.54) EPHX2FAAHTRPV1PDE2AGCGR
SCHEMBL2654825 0.86 GCGR (0.53) EPHX2FAAHTRPV1GCGRADCY6

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 EPHX2 3463/4885FAAH 832/4885ALDH1A1 3968/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR EPHX2 3463/4885FAAH 832/4885ALDH1A1 3968/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR EPHX2 3463/4885FAAH 832/4885ALDH1A1 3968/4885

“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.