SCHEMBL20550309

SCHEMBL20550309

CCc1cnc(N2CCC(COc3ccc(C4=CCC(CC)CC4)cc3F)CC2)nc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 17/20 0.47
▸ TLR9 Q9NR96 2/20 0.37
▸ TLR8 Q9NR97 2/20 0.37
▸ TLR7 Q9NYK1 2/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.36

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
SCHEMBL20550517 0.88 TBK1 (0.42) GPR119
SCHEMBL18843837 0.87 GPR119 (0.50) GPR119FFAR4
SCHEMBL18825378 0.85 GPR119 (0.48) GPR119FFAR4
SCHEMBL18825503 0.85 GPR119 (0.48) GPR119FFAR4
SCHEMBL18825519 0.85 GPR119 (0.48) GPR119FFAR4
SCHEMBL18825334 0.84 GPR119 (0.48) GPR119FFAR4
SCHEMBL20550622 0.84 GPR119 (0.43) GPR119
SCHEMBL18825442 0.84 GPR119 (0.47) GPR119FFAR4
SCHEMBL18825326 0.84 GPR119 (0.47) GPR119FFAR4
SCHEMBL18825443 0.84 GPR119 (0.47) GPR119FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180318274-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT HYUNDAI PHARM CO., LTD. (KR) 2018-11-08 — — 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 (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-20180318274-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT GPR119, GLP1R, GCGR GPR119 1/4885TLR9 900/4885TLR8 2006/4885

“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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