SCHEMBL719341

SCHEMBL719341

CCc1nn(-c2ccc(OC)cc2)cc1C(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.41
GCG P01275 6/20 0.37
GCGR P47871 2/20 0.37
GLP1R P43220 1/20 0.37
GIPR P48546 1/20 0.37
AURKA O14965 3/20 0.36
MAPT P10636 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
OPRM1 P35372 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34

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 0.93 SLC6A9 (0.41) SLC6A9GCGGCGRGLP1RGIPR
SCHEMBL3399863 0.93 KMT2A (0.38) SLC6A9GCGGCGRMAPTMEN1
SCHEMBL717855 0.91 SLC6A9 (0.42) SLC6A9GCGGCGRGLP1RGIPR
SCHEMBL718196 0.89 SLC6A9 (0.41) SLC6A9GCGGCGRGLP1RGIPR
SCHEMBL719861 0.89 SLC6A9 (0.41) SLC6A9GCGGCGRGLP1RGIPR
SCHEMBL721158 0.89 GCG (0.39) GCGAURKAMAPTMEN1KMT2A
SCHEMBL718868 0.89 GCGR (0.49) GCGGCGRGLP1RGIPR
SCHEMBL716584 0.89 HIF1A (0.40) SLC6A9GCGMAPTMEN1KMT2A
SCHEMBL721166 0.87 GCG (0.37) SLC6A9GCGGCGRGLP1RGIPR
SCHEMBL717935 0.87 GCG (0.51) GCGGCGRGLP1RGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 SLC6A9 1426/4885GCG 35/4885GCGR 90/4885
US-20120270865-A2 HETEROCYCLIC COMPOUND SLC5A2, SLC5A1, IAPP SLC6A9 1426/4885GCG 35/4885GCGR 90/4885

“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.