SCHEMBL623302

SCHEMBL623302

CC(C)(C)OC(=O)N1CCN(c2cc(OC3CCC3)ncn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.54
MAP4K4 O95819 1/20 0.47
ACACB O00763 2/20 0.46
CKS1B P61024 2/20 0.44
SKP1 P63208 2/20 0.44
SKP2 Q13309 2/20 0.44

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
SCHEMBL14973123 0.83 GPR119 (0.55) GPR119MAP4K4CKS1BSKP1SKP2
SCHEMBL624511 0.81 GPR119 (0.52) GPR119MAP4K4ACACBCKS1BSKP1
SCHEMBL3103887 0.80 GPR119 (0.51) GPR119MAP4K4CKS1BSKP1SKP2
SCHEMBL1066568 0.79 GPR119 (0.57) GPR119
SCHEMBL2524108 0.79 GPR119 (0.57) GPR119
SCHEMBL624296 0.79 GPR119 (0.50) GPR119MAP4K4CKS1BSKP1SKP2
SCHEMBL3485950 0.79 GPR119 (0.70) GPR119
SCHEMBL623305 0.79 GPR119 (0.50) GPR119MAP4K4ACACBCKS1BSKP1
SCHEMBL26669649 0.78 GPR119 (0.57) GPR119MAP4K4CKS1BSKP1SKP2
SCHEMBL1159689 0.78 GPR119 (0.56) GPR119

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
US-8999974-B2 Acyl piperazine derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-04-07 US disclosed
US-20130150356-A1 Acyl Piperazine Derivatives as TTX-S Blockers RAQUALIA PHARMA INC. (JP) 2013-06-13 US disclosed
WO-2012020567-A1 ACYL PIPERAZINE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-02-16 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-20130150356-A1 Acyl Piperazine Derivatives as TTX-S Blockers SCN5A, SCN2A, CACNA1G GPR119 2377/4885MAP4K4 3685/4885ACACB 544/4885

“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.