SCHEMBL4085743

SCHEMBL4085743

CC(C)(C)C1CCC(C(NC(=O)Nc2ccc(OC(F)(F)F)cc2)c2ccc(C(=O)Nc3ncnc4[nH]ncc34)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
FLT3 P36888 6/20 0.43
KDR P35968 1/20 0.41
GCGR P47871 2/20 0.41
GIPR P48546 1/20 0.41
PDE2A O00408 5/20 0.41
TRPV1 Q8NER1 1/20 0.41
PAK1 Q13153 2/20 0.40
NAMPT P43490 1/20 0.39
AURKA O14965 1/20 0.39
PDPK1 O15530 1/20 0.39
RPS6KB1 P23443 1/20 0.39

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
SCHEMBL4087861 0.89 FLT3 (0.45) FLT3PAK1RPS6KB1
SCHEMBL4095984 0.85 FLT3 (0.41) FLT3PAK1
SCHEMBL4096368 0.80 EPHX2 (0.53) GCGRGIPRPDE2ATRPV1
SCHEMBL4091871 0.80 EPHX2 (0.54) GCGRGIPRPDE2ATRPV1
SCHEMBL4096553 0.80 EPHX2 (0.53) GCGRGIPRPDE2ATRPV1
SCHEMBL4096367 0.80 EPHX2 (0.53) GCGRGIPRPDE2ATRPV1
SCHEMBL2659918 0.80 EPHX2 (0.54) GCGRGIPRPDE2ATRPV1
SCHEMBL2659919 0.80 EPHX2 (0.54) GCGRGIPRPDE2ATRPV1
SCHEMBL4085738 0.79 GCGR (0.67) GCGRGIPR
SCHEMBL4087450 0.79 GCGR (0.64) GCGRGIPR

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 ABL1 4455/4885BCR 4570/4885FLT3 3049/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR ABL1 4455/4885BCR 4570/4885FLT3 3049/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR ABL1 4455/4885BCR 4570/4885FLT3 3049/4885

“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.