SCHEMBL3095477

SCHEMBL3095477

Cc1nn(C)c(C)c1-c1cc(C(Nc2ccc(C(=O)N(C)CCC(=O)O)cc2)C2CCCCC2)c(C)o1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCG P01275 10/20 0.35
RCE1 Q9Y256 1/20 0.34
PDE7A Q13946 2/20 0.33
PIK3CA P42336 2/20 0.33
MTOR P42345 2/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
GLP1R P43220 1/20 0.31
GCGR P47871 1/20 0.31
GIPR P48546 1/20 0.31
MCHR1 Q99705 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
HPGD P15428 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL3089964 0.88 GCG (0.35) GCGRCE1
SCHEMBL3095498 0.87 RCE1 (0.44) GCGRCE1PDE7A
SCHEMBL3104163 0.87 GCG (0.48) GCGGLP1RGCGRGIPR
SCHEMBL13093864 0.84 ALDH1A1 (0.41) GCGRCE1MCHR1HPGD
SCHEMBL3095461 0.84 GCG (0.38) GCGRCE1PDE7AGLP1RGCGR
SCHEMBL3109932 0.83 RCE1 (0.38) GCGRCE1PIK3CAPIK3CDPIK3CB
SCHEMBL3102136 0.83 ALDH1A1 (0.41) GCGRCE1MCHR1TRPV4HPGD
SCHEMBL3107019 0.82 RCE1 (0.35) GCGRCE1HPGDEPHX2
SCHEMBL3106912 0.82 MMP13 (0.37) GCGRCE1MCHR1
SCHEMBL3102500 0.82 TACR1 (0.39) GCGRCE1PIK3CBMCHR1

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 GCG 11/4885RCE1 3126/4885PDE7A 3129/4885

“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.