SCHEMBL17925041

SCHEMBL17925041

CC(C)(C)OC(=O)N1CCC2(CC1)CN(c1cnc(S(C)(=O)=O)cn1)C2

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 14/20 0.52
▸ RET P07949 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ KCNJ1 P48048 1/20 0.43
▸ CYP11B2 P19099 1/20 0.43
▸ ACACB O00763 1/20 0.43
▸ CKS1B P61024 1/20 0.41
▸ SKP1 P63208 1/20 0.41
▸ SKP2 Q13309 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
SCHEMBL16432478 0.83 GPR119 (0.52) GPR119RETALDH1A1CYP3A4CYP2D6
SCHEMBL17925050 0.81 GPR119 (0.50) GPR119ALDH1A1CYP3A4KCNJ1CYP11B2
SCHEMBL30328115 0.80 CYP11B2 (0.51) GPR119RETALDH1A1CYP3A4CYP2D6
SCHEMBL17925127 0.78 GPR119 (0.54) GPR119KCNJ1CYP11B2
SCHEMBL1753703 0.78 RET (0.51) GPR119RETALDH1A1CYP3A4CYP2D6
SCHEMBL14161243 0.78 RET (0.51) GPR119RETALDH1A1CYP3A4CYP2D6
SCHEMBL17925118 0.77 GPR119 (0.51) GPR119RETCYP2D6HSD17B10KCNJ1
SCHEMBL17925046 0.77 GPR119 (0.54) GPR119CYP11B2
SCHEMBL16430912 0.76 GPR119 (0.55) GPR119RETALDH1A1CYP3A4CYP2D6
SCHEMBL30329263 0.76 CYP11B2 (0.48) GPR119RETALDH1A1CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3027625-B1 SPIRO-FUSED DERIVATIVES OF PIPERIDINE USEFUL FOR THE TREATMENT OF INTER ALIA HYPERTENSION AND ACUTE OR CHRONIC HEART FAILURE MERCK SHARP & DOHME (US) 2018-05-30 — — EP disclosed
US-9751881-B2 Inhibitors of the renal outer medullary potassium channel MERCK SHARP & DOHME CORP. (US) 2017-09-05 — — US disclosed
US-20160207922-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2016-07-21 — — 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-20160207922-A1 Inhibitors of the Renal Outer Medullary Potassium Channel KCNJ11, KCNJ1, KCNJ2 GPR119 1088/4885RET 681/4885ALDH1A1 1722/4885

“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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