SCHEMBL387433

SCHEMBL387433

CC(C)Cc1noc(N2CCC(COc3ccc(Br)cc3)CC2)n1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.49
GPR183 P32249 1/20 0.46
CXCR1 P25024 1/20 0.41
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
S1PR1 P21453 1/20 0.36
ACACB O00763 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35
EGFR P00533 1/20 0.35
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL387558 0.85 GPR119 (0.66) GPR119GPR183CXCR1
SCHEMBL387512 0.83 GPR119 (0.65) GPR119GPR183CXCR1
SCHEMBL387732 0.74 GPR119 (0.66) GPR119GPR183
SCHEMBL12506155 0.72 GPR119 (0.62) GPR119KDM4E
SCHEMBL387527 0.72 GPR119 (0.62) GPR119GPR183CXCR1
SCHEMBL461992 0.72 GPR119 (0.55) GPR119GPR183ACACB
SCHEMBL18825361 0.71 GPR119 (0.57) GPR119GPR183
SCHEMBL461635 0.70 GPR119 (0.44) GPR119GPR183
SCHEMBL2567580 0.70 GPR119 (0.40) GPR119S1PR1
SCHEMBL18574754 0.70 GPR119 (0.53) GPR119GPR183HRH3EGFR

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-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-2094683-B1 Bicyclic compounds and use as antidiabetics GLAXOSMITHKLINE LLC (US) 2011-10-12 EP 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 GPR119 1/4885GPR183 1491/4885CXCR1 4290/4885
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC GPR119 1/4885GPR183 1491/4885CXCR1 4290/4885

“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.