SCHEMBL1827279

SCHEMBL1827279

CCCCOC(=O)NC1CCCC1

nearest known ligand 0.84

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.64
GAA P10253 1/20 0.56
MAPK1 P28482 1/20 0.56
HTT P42858 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
EPHX2 P34913 2/20 0.52

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
SCHEMBL2801497 0.98 EPHX1 (0.67) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL26677284 0.96 EPHX1 (0.59) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL14424446 0.95 EPHX1 (0.67) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL21059112 0.93 EPHX1 (0.69) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL4719490 0.93 GAA (0.59) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL13387564 0.93 GAA (0.59) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL1690687 0.92 EPHX1 (0.68) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL10811922 0.92 EPHX1 (0.68) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL28059725 0.92 EPHX1 (0.68) EPHX1GAAMAPK1HTTSMN1; SMN2
SCHEMBL16146100 0.90 GAA (0.54) EPHX1GAAMAPK1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110183974-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS INSTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2011-07-28 US disclosed
EP-2318400-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS Istituto Di Ricerche Di Biologia Molecolare P. Angeletti S.P.A. (IT) 2011-05-11 EP disclosed
WO-2010013037-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2010-02-04 WO disclosed
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
CN-1257889-C Novel amino acid derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2006-05-31 CN 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-20110183974-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS SHH, SMO, GLI1 EPHX1 2252/4885GAA 4330/4885MAPK1 749/4885

“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.