SCHEMBL388598

SCHEMBL388598

CC(C)(C)OC(=O)N1CCN(c2noc(C(C)(C)C)n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.48
GPR119 Q8TDV5 6/20 0.45
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ACHE P22303 1/20 0.44
PIK3CA P42336 2/20 0.43
CKS1B P61024 1/20 0.43
SKP1 P63208 1/20 0.43
SKP2 Q13309 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
PTPN11 Q06124 1/20 0.43
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAP4K4 O95819 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
SCHEMBL28552685 0.90 HDAC4 (0.60) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL14991092 0.85 GPR119 (0.47) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL16197362 0.82 GPR119 (0.46) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL386442 0.82 EPHA2 (0.46) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL10297496 0.81 GPR119 (0.55) GPR119USP2SMN1; SMN2ACHEPIK3CA
SCHEMBL391002 0.81 EPHA2 (0.47) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL390557 0.81 EPHA2 (0.47) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL18282510 0.80 EPHA2 (0.51) HDAC4GPR119USP2SMN1; SMN2ACHE
SCHEMBL15143239 0.79 HDAC4 (0.43) HDAC4GPR119ACHEPIK3CACKS1B
SCHEMBL15136826 0.78 ACHE (0.43) HDAC4GPR119ACHEPIK3CACKS1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090062293-A1 1,4-Substituted Piperazine Derivatives MSD K.K. (JP) 2009-03-05 US claimed
EP-1870401-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-12-26 EP claimed
US-8101618-B2 1,4-substituted piperazine derivatives MSD K.K. (JP) 2012-01-24 US disclosed
US-8101618-B2 1,4-substituted piperazine derivatives MSD K.K. (JP) 2012-01-24 US disclosed
US-8101618-B2 1,4-substituted piperazine derivatives MSD K.K. (JP) 2012-01-24 US disclosed
US-20090062293-A1 1,4-Substituted Piperazine Derivatives MSD K.K. (JP) 2009-03-05 US disclosed
US-20090062293-A1 1,4-Substituted Piperazine Derivatives MSD K.K. (JP) 2009-03-05 US disclosed
US-20090062293-A1 1,4-Substituted Piperazine Derivatives MSD K.K. (JP) 2009-03-05 US disclosed
EP-1870401-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-12-26 EP 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-20090062293-A1 1,4-Substituted Piperazine Derivatives GRIN1, GRM1, GRIN2C HDAC4 1829/4885GPR119 137/4885USP2 4359/4885

“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.