SCHEMBL3107529

SCHEMBL3107529

Cc1oc(-c2ccc(C(F)(F)F)cn2)cc1C(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCG P01275 12/20 0.41
GLP1R P43220 1/20 0.39
GCGR P47871 1/20 0.39
GIPR P48546 1/20 0.39
MCHR1 Q99705 3/20 0.35
RCE1 Q9Y256 1/20 0.34
SCN9A Q15858 1/20 0.34
EPHX2 P34913 1/20 0.34
AKR1C3 P42330 1/20 0.34

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
SCHEMBL3102733 0.90 GCG (0.35) GCGMCHR1RCE1EPHX2
SCHEMBL3107023 0.89 GLP1R (0.39) GCGGLP1RGCGRGIPRMCHR1
SCHEMBL3111487 0.88 GCG (0.54) GCGGLP1RGCGRGIPR
SCHEMBL3110245 0.88 RCE1 (0.44) GCGGLP1RGCGRGIPRMCHR1
SCHEMBL3101825 0.88 MMP13 (0.40) GCGMCHR1RCE1EPHX2AKR1C3
SCHEMBL3099916 0.86 RCE1 (0.41) GCGRCE1EPHX2
SCHEMBL3107019 0.85 RCE1 (0.35) GCGRCE1EPHX2AKR1C3
SCHEMBL3107670 0.83 RCE1 (0.34) GCGGCGRMCHR1RCE1EPHX2
SCHEMBL3101718 0.83 PTGS2 (0.37) GCGMCHR1RCE1AKR1C3
SCHEMBL13094229 0.83 HPGD (0.39) GCGMCHR1RCE1EPHX2AKR1C3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
EP-2210876-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-07-28 EP 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 (1 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-20100256156-A1 HETEROCYCLIC COMPOUND GLP1R, GPR119, GCGR GCG 11/4885GLP1R 1/4885GCGR 3/4885

“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.