SCHEMBL718349

SCHEMBL718349

CCc1nn(-c2ccc(OC)cc2)cc1C(Nc1ccc(C(=O)NCCC(=O)OC(c2cn(-c3ccc(OC)cc3)nc2CC)C2CCCCC2)cc1)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCG P01275 8/20 0.44
GCGR P47871 6/20 0.42
GIPR P48546 2/20 0.42
GLP1R P43220 1/20 0.42
CTSL P07711 2/20 0.40
CTSS P25774 2/20 0.40
CTSK P43235 2/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
MDM2 Q00987 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DGAT1 O75907 1/20 0.38

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
SCHEMBL717935 0.91 GCG (0.51) GCGGCGRGIPRGLP1R
SCHEMBL718289 0.88 GCGR (0.44) GCGGCGRGIPRGLP1RCTSL
SCHEMBL718348 0.88 GCG (0.48) GCGGCGRGIPRGLP1R
SCHEMBL718408 0.84 GCG (0.51) GCGGCGRGIPRGLP1R
SCHEMBL717442 0.84 KDM4E (0.42) GCGGCGRGIPRGLP1RCTSL
SCHEMBL720065 0.83 DGAT1 (0.44) GCGGCGRGIPRGLP1RRAB9A
SCHEMBL718915 0.82 GCG (0.55) GCGGCGRGIPRGLP1R
SCHEMBL719474 0.82 GCG (0.47) GCGGCGRGIPRGLP1RCTSL
SCHEMBL719347 0.81 GCG (0.49) GCGGCGRGIPRGLP1RRAB9A
SCHEMBL720849 0.81 GCGR (0.53) GCGGCGRGIPRGLP1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053173-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-01 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 (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-20120053173-A1 HETEROCYCLIC COMPOUND SLC5A2, SLC5A1, IAPP GCG 35/4885GCGR 90/4885GIPR 41/4885

“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.