SCHEMBL3089995

SCHEMBL3089995

CCOC(=O)CCN(C)C(=O)c1ccc(NC(c2cc(-c3ccc(C(F)(F)F)cc3)oc2CC)C2CCCCC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.36
IDH1 O75874 1/20 0.34
GCG P01275 4/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
GLP1R P43220 1/20 0.32
GCGR P47871 1/20 0.32
GIPR P48546 1/20 0.32
TRPM2 O94759 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
CETP P11597 1/20 0.32

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
SCHEMBL3099349 0.93 MCHR1 (0.35) MCHR1IDH1GCGKDM4EMAPT
SCHEMBL3089930 0.93 MCHR1 (0.34) MCHR1IDH1GCGKDM4EMAPT
SCHEMBL3104110 0.92 GLP1R (0.39) MCHR1GCGGLP1RGCGRGIPR
SCHEMBL3093860 0.92 MCHR1 (0.34) MCHR1IDH1GCGKDM4EMAPT
SCHEMBL3113352 0.87 GCGR (0.36) MCHR1GCGGLP1RGCGRGIPR
SCHEMBL3107604 0.85 MCHR1 (0.37) MCHR1GCGGLP1RGCGRGIPR
SCHEMBL3107023 0.85 GLP1R (0.39) MCHR1GCGGLP1RGCGRGIPR
SCHEMBL3094591 0.84 L3MBTL1 (0.34) MCHR1IDH1GCGMAPT
SCHEMBL3106477 0.84 GLP1R (0.37) MCHR1GCGMAPTGLP1RGCGR
SCHEMBL3102108 0.83 RCE1 (0.41) MCHR1GCGGLP1RGCGRGIPR

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 4 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-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 MCHR1 213/4885IDH1 1001/4885GCG 11/4885

“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.