SCHEMBL12506069

SCHEMBL12506069

CC(C)c1noc(C2CCN(c3ncnc4c(-c5ccc(N)cc5)csc34)CC2)n1

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 18/20 0.79
▸ CYP3A4 P08684 2/20 0.79
▸ CYP2C19 P33261 2/20 0.79
▸ CNR2 P34972 1/20 0.46
▸ SCN9A Q15858 1/20 0.41

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
SCHEMBL12506097 0.88 GPR119 (1.00) GPR119CYP3A4CYP2C19
SCHEMBL15312685 0.88 GPR119 (0.77) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL12506086 0.87 GPR119 (0.78) GPR119CYP3A4CYP2C19CNR2
SCHEMBL12506049 0.87 GPR119 (0.86) GPR119CYP3A4CYP2C19CNR2
SCHEMBL12506044 0.87 GPR119 (0.85) GPR119CYP3A4CYP2C19CNR2
SCHEMBL12506065 0.86 GPR119 (0.73) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL12505966 0.85 GPR119 (0.70) GPR119CYP3A4CYP2C19CNR2SCN9A
SCHEMBL15312765 0.85 GPR119 (0.82) GPR119CYP3A4CYP2C19CNR2
SCHEMBL12506165 0.84 GPR119 (0.81) GPR119CYP3A4CYP2C19
SCHEMBL12506161 0.83 GPR119 (0.66) GPR119CYP3A4CYP2C19CNR2SCN9A

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-8853213-B2 Bicyclic compound for modulating G protein-coupled receptors HANMI PHARM. CO., LTD (KR) 2014-10-07 — — US disclosed
US-8853213-B2 Bicyclic compound for modulating G protein-coupled receptors HANMI PHARM. CO., LTD (KR) 2014-10-07 — — US disclosed
US-8853213-B2 Bicyclic compound for modulating G protein-coupled receptors HANMI PHARM. CO., LTD (KR) 2014-10-07 — — US disclosed
EP-2661438-A2 NEW BICYCLIC COMPOUND FOR MODULATING G PROTEIN-COUPLED RECEPTORS Hanmi Pharm. Co., Ltd. (KR) 2013-11-13 — — EP disclosed
US-20130274268-A1 NEW BICYCLIC COMPOUND FOR MODULATING G PROTEIN-COUPLED RECEPTORS HANMI PHARM. CO., LTD (KR) 2013-10-17 — — US disclosed
WO-2012093809-A2 NEW BICYCLIC COMPOUND FOR MODULATING G PROTEIN-COUPLED RECEPTORS HANMI PHARM CO., LTD. (KR) 2012-07-12 — — 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 (1 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-20130274268-A1 NEW BICYCLIC COMPOUND FOR MODULATING G PROTEIN-COUPLED RECEPTORS GPR119, GPR65, GPR3 GPR119 1/4885CYP3A4 3885/4885CYP2C19 2773/4885

“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.

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