SCHEMBL387614

SCHEMBL387614

CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(-c3ccc(S(C)(=O)=O)cc3)nc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 2/20 0.64
PTPN1 P18031 2/20 0.64
PTPN6 P29350 1/20 0.64
GPR119 Q8TDV5 15/20 0.61
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ABL1 P00519 1/20 0.52
RIN1 Q13671 1/20 0.52
STS P08842 1/20 0.50

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
SCHEMBL3841211 0.85 GPR119 (0.61) PTPN2PTPN1PTPN6GPR119
SCHEMBL870008 0.85 GPR119 (0.59) GPR119
Trifluoroacetic Acid SCHEMBL387544 0.81 GPR119 (0.55) GPR119
SCHEMBL3987089 0.80 GPR119 (0.59) GPR119
SCHEMBL387392 0.79 GPR119 (0.69) GPR119
SCHEMBL388631 0.79 PTPN2 (0.69) PTPN2PTPN1PTPN6GPR119NPC1
SCHEMBL14191011 0.79 GPR119 (0.60) GPR119
SCHEMBL14167732 0.78 GPR119 (0.90) GPR119
SCHEMBL387275 0.77 GPR119 (0.66) GPR119
SCHEMBL12569747 0.77 GPR119 (0.66) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS FANG JING (US) 2012-03-29 US disclosed
US-8101634-B2 Bicyclic compounds and use as antidiabetics GLAXOSMITHKLINE LLC (US) 2012-01-24 US disclosed
EP-2325182-A1 Bicyclic compounds and use as antidiabetics Glaxosmithkline LLC (US) 2011-05-25 EP disclosed
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITH KLINE BEECHAM CORPORATION a corporation 2010-02-04 US disclosed
EP-2094683-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SmithKline Beecham Corporation (US) 2009-09-02 EP disclosed
WO-2008070692-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITHKLINE BEECHAM CORPORATION (US) 2008-06-12 WO 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-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC PTPN2 3234/4885PTPN1 4085/4885PTPN6 3691/4885
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC PTPN2 3234/4885PTPN1 4085/4885PTPN6 3691/4885

“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.