SCHEMBL5158725

SCHEMBL5158725

CC(C)(C)OC(=O)N1CCC(O)C(c2ccccn2)C1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.56
USP30 Q70CQ3 5/20 0.52
GRM5 P41594 1/20 0.44
HPGDS O60760 1/20 0.44
POLB P06746 1/20 0.44
USP7 Q93009 1/20 0.44
MMP13 P45452 1/20 0.44
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
CCNK O75909 1/20 0.42
CDK12 Q9NYV4 1/20 0.42

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
SCHEMBL5157060 1.00 GPR119 (0.56) GPR119USP30GRM5HPGDSPOLB
SCHEMBL18115645 0.84 GPR119 (0.59) GPR119USP30HPGDS
SCHEMBL21775442 0.83 GPR119 (0.50) GPR119USP30POLBJAK2JAK1
SCHEMBL21748690 0.83 GPR119 (0.50) GPR119USP30POLBJAK2JAK1
SCHEMBL21748693 0.83 GPR119 (0.50) GPR119USP30POLBJAK2JAK1
SCHEMBL30783205 0.83 GPR119 (0.50) GPR119USP30POLBJAK2JAK1
SCHEMBL5923783 0.82 RORC (0.57) GPR119USP30HPGDSUSP7JAK2
SCHEMBL4489075 0.82 RORC (0.57) GPR119USP30HPGDSUSP7JAK2
SCHEMBL4080053 0.82 GPR119 (0.65) GPR119USP30HPGDSPOLBMMP13
SCHEMBL4484794 0.82 RORC (0.57) GPR119USP30HPGDSUSP7JAK2

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-1748984-A1 PIPERIDINE DERIVATIVES AS NK1 AND NK3 ANTAGONISTS Pfizer Products Inc. (US) 2007-02-07 EP disclosed
WO-2005110987-A1 PIPERIDINE DERIVATIVES AS NK1 AND NK3 ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-24 WO disclosed
US-20050256164-A1 NK1 and NK3 antagonists PFIZER INC 2005-11-17 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-20050256164-A1 NK1 and NK3 antagonists TAC3, TACR1, TACR2 GPR119 522/4885USP30 3958/4885GRM5 488/4885

“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.