SCHEMBL3107541

SCHEMBL3107541

CCc1sc(-c2ccc(C(F)(F)F)cc2)cc1C(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 1/20 0.39
GCGR P47871 1/20 0.39
GIPR P48546 1/20 0.39
GCG P01275 6/20 0.38
MCHR1 Q99705 9/20 0.37
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
AKR1C3 P42330 1/20 0.35

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
SCHEMBL3102629 0.91 GLP1R (0.39) GLP1RGCGRGIPRGCGMCHR1
SCHEMBL3091283 0.88 RCE1 (0.41) GLP1RGCGRGIPRGCGMCHR1
SCHEMBL3102340 0.88 GCGR (0.51) GLP1RGCGRGIPRGCG
SCHEMBL3101838 0.86 GLP1R (0.39) GLP1RGCGRGIPRGCGMCHR1
SCHEMBL3107556 0.86 GCGR (0.42) GCGRGCGMCHR1AKR1C3
SCHEMBL3104110 0.83 GLP1R (0.39) GLP1RGCGRGIPRGCGMCHR1
SCHEMBL3102441 0.83 RCE1 (0.36) GCG
SCHEMBL3095309 0.82 RCE1 (0.35) GCG
SCHEMBL3107023 0.81 GLP1R (0.39) GLP1RGCGRGIPRGCGMCHR1
SCHEMBL3100356 0.81 RCE1 (0.32)

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 8 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
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-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
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 GLP1R 1/4885GCGR 3/4885GIPR 7/4885

“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.