SCHEMBL718930

SCHEMBL718930

COCc1nn(-c2ccccc2)cc1C(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCG P01275 11/20 0.39
SLC6A9 P48067 1/20 0.37
GLP1R P43220 1/20 0.37
GCGR P47871 1/20 0.37
GIPR P48546 1/20 0.37
RCE1 Q9Y256 1/20 0.37
NAMPT P43490 1/20 0.35
ABL1 P00519 1/20 0.34
RIN1 Q13671 1/20 0.34
P2RX7 Q99572 1/20 0.33

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
SCHEMBL721415 0.94 SLC6A9 (0.41) GCGSLC6A9GLP1RGCGRGIPR
SCHEMBL10242831 0.93 MEN1 (0.38) GCGSLC6A9GLP1RGCGRGIPR
SCHEMBL27946275 0.91 GCG (0.38) GCGSLC6A9RCE1NAMPT
SCHEMBL718125 0.91 GCGR (0.43) GCGSLC6A9GLP1RGCGRGIPR
SCHEMBL721090 0.89 ABL1 (0.40) GCGSLC6A9GLP1RGCGRGIPR
SCHEMBL718414 0.88 GCG (0.43) GCGSLC6A9GLP1RGCGRGIPR
SCHEMBL719392 0.87 GCG (0.51) GCGGLP1RGCGRGIPR
SCHEMBL3399863 0.87 KMT2A (0.38) GCGSLC6A9GCGRRCE1
SCHEMBL719341 0.87 SLC6A9 (0.41) GCGSLC6A9GLP1RGCGRGIPR
SCHEMBL720377 0.86 GCG (0.38) GCGGLP1RGCGRGIPRRCE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102015641-B Heterocyclic compound TAKEDA PHARMACEUTICAL 2014-01-01 CN disclosed
US-8436043-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-05-07 US disclosed
US-8436043-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-05-07 US disclosed
US-20120270865-A2 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-25 US disclosed
US-20120270865-A2 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-25 US disclosed
US-20120270865-A2 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-25 US disclosed
US-20120053173-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-01 US disclosed
US-20120053173-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-01 US disclosed
CN-102015641-A Heterocyclic compound TAKEDA PHARMACEUTICAL 2011-04-13 CN disclosed
EP-2251326-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-11-17 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 (2 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 35/4885SLC6A9 1426/4885GLP1R 5/4885
US-20120270865-A2 HETEROCYCLIC COMPOUND SLC5A2, SLC5A1, IAPP GCG 35/4885SLC6A9 1426/4885GLP1R 5/4885

“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.