SCHEMBL1557792

SCHEMBL1557792

CCc1cnc(N2CCC(c3cccc(COc4ccc(-n5cnnn5)cc4F)n3)CC2)nc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.59
RXRA P19793 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
KCNH2 Q12809 1/20 0.37

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
SCHEMBL1557529 0.90 GPR119 (0.48) GPR119RXRAGRIN1GRIN2BKCNH2
SCHEMBL1118428 0.85 GPR119 (0.60) GPR119RXRAGRIN1GRIN2BKCNH2
SCHEMBL3489484 0.85 GPR119 (0.78) GPR119
SCHEMBL3690209 0.83 GPR119 (0.58) GPR119RXRAGRIN1GRIN2BKCNH2
SCHEMBL11305675 0.82 GPR119 (0.43) GPR119RXRAGRIN1GRIN2B
SCHEMBL1556639 0.82 GPR119 (0.48) GPR119
SCHEMBL3685869 0.82 GPR119 (0.58) GPR119RXRAGRIN1GRIN2BKCNH2
Hydrochloric Acid SCHEMBL1558374 0.81 GPR119 (0.42) GPR119RXRAGRIN1GRIN2B
SCHEMBL1557144 0.81 GPR119 (0.55) GPR119KCNH2
SCHEMBL3691499 0.81 GPR119 (0.55) GPR119RXRAGRIN1GRIN2BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120184572-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. 2012-07-19 US disclosed
US-20120184572-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. 2012-07-19 US disclosed
US-20120184572-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. 2012-07-19 US disclosed
US-20110294836-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2011-12-01 US disclosed
US-20110294836-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2011-12-01 US disclosed
US-20110294836-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2011-12-01 US disclosed
EP-2303859-A2 ARYL GPR119 AGONISTS AND USES THEREOF Metabolex Inc. (US) 2011-04-06 EP disclosed
WO-2010008739-A2 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2010-01-21 WO disclosed
WO-2010008739-A2 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2010-01-21 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-20120184572-A1 ARYL GPR119 AGONISTS AND USES THEREOF GPR119, GPR27, GPR65 GPR119 1/4885RXRA 319/4885GRIN1 1562/4885
US-20110294836-A1 ARYL GPR119 AGONISTS AND USES THEREOF GPR119, GPR27, GPR65 GPR119 1/4885RXRA 319/4885GRIN1 1562/4885

“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.