SCHEMBL6086048

SCHEMBL6086048

C=CCC(C)(C)C(=O)Nc1ccc(-c2n[nH]cc2-c2nc3c(C)ccc(C(C)C)c3o2)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CEPT1 Q9Y6K0 9/20 0.33
CETP P11597 7/20 0.32
DGAT1 O75907 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
XBP1 P17861 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL6085366 0.88 CEPT1 (0.34) CEPT1CETPDGAT1KDM4EALDH1A1
SCHEMBL6084636 0.80 CEPT1 (0.34) CEPT1CETPKDM4EALDH1A1TP53
SCHEMBL6085080 0.78 MAPT (0.49) CEPT1CETPKDM4EALDH1A1TP53
SCHEMBL6086404 0.77 POLB (0.45) CEPT1CETPKDM4EALDH1A1TP53
SCHEMBL6086210 0.76 CETP (0.41) CEPT1CETPKDM4ETP53
SCHEMBL6086379 0.76 CETP (0.40) CEPT1CETPKDM4EALDH1A1TP53
SCHEMBL6084760 0.76 MAPT (0.44) ALDH1A1TP53
SCHEMBL6085964 0.76 CEPT1 (0.52) CEPT1CETPTP53
SCHEMBL6085797 0.74 NPC1 (0.42) KDM4EALDH1A1TP53
SCHEMBL6084819 0.73 ALDH1A1 (0.44) KDM4EALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 US claimed
EP-1377589-A1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-01-07 EP claimed
WO-2002062804-A1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2002-08-15 WO claimed
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US disclosed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP disclosed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 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-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors MAP3K15, MAP3K20, MAP3K3 CEPT1 2798/4885CETP 4875/4885DGAT1 4146/4885

“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.