SCHEMBL5156856

SCHEMBL5156856

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

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.50
GRM5 P41594 4/20 0.49
USP30 Q70CQ3 3/20 0.48
GRM1 Q13255 3/20 0.47
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.43
MAPT P10636 1/20 0.41
DTYMK P23919 1/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
NR1H2 P55055 1/20 0.40

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
SCHEMBL21748717 0.82 POLB (0.45) GPR119GRM5USP30GRM1POLB
SCHEMBL1617581 0.82 RORC (0.48) GPR119USP30MAPK1JAK2JAK1
SCHEMBL28491036 0.81 GPR119 (0.56) GPR119GRM5USP30GRM1POLB
SCHEMBL18115645 0.80 GPR119 (0.59) GPR119USP30
SCHEMBL5161957 0.80 GPR119 (0.43) GPR119GRM5USP30GRM1MAPK1
SCHEMBL30783165 0.80 GPR119 (0.43) GPR119GRM5USP30GRM1MAPK1
SCHEMBL27211314 0.80 GRM1 (0.44) GPR119GRM5USP30GRM1MAPK1
SCHEMBL31228209 0.79 GPR119 (0.54) GPR119GRM5USP30GRM1POLB
SCHEMBL2998444 0.79 GPR119 (0.54) GPR119GRM5USP30GRM1POLB
SCHEMBL15359029 0.79 GPR119 (0.47) GPR119GRM5USP30GRM1POLB

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 522/4885GRM5 488/4885USP30 3958/4885

“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.