SCHEMBL6086493

SCHEMBL6086493

Cc1cccc2oc(-c3c[nH]nc3-c3ccc(NC(=O)c4ccc(C#N)nc4)cc3)nc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CEPT1 Q9Y6K0 5/20 0.48
PTPN1 P18031 1/20 0.44
AGPAT2 O15120 2/20 0.42
LRRK2 Q5S007 1/20 0.41
MAPT P10636 8/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SLC6A3 Q01959 1/20 0.40
KCNH2 Q12809 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
TP53 P04637 4/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
STAT3 P40763 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL6084612 0.84 MAPT (0.55) CEPT1PTPN1AGPAT2MAPTTP53
SCHEMBL6085024 0.81 CEPT1 (0.46) CEPT1AGPAT2MAPTRXFP1TP53
SCHEMBL6085967 0.79 CEPT1 (0.51) CEPT1AGPAT2MAPTRXFP1SLC6A3
SCHEMBL6085859 0.79 CEPT1 (0.51) CEPT1AGPAT2MAPTRXFP1TP53
SCHEMBL6086666 0.79 CEPT1 (0.49) CEPT1AGPAT2MAPTRXFP1TP53
SCHEMBL6086300 0.78 CEPT1 (0.47) CEPT1AGPAT2MAPTRXFP1TP53
SCHEMBL6084017 0.76 CEPT1 (0.52) CEPT1AGPAT2MAPTRXFP1TP53
SCHEMBL6084877 0.76 RAB9A (0.52) CEPT1MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL6085752 0.76 MAPT (0.48) CEPT1AGPAT2MAPTKDM4EMEN1
SCHEMBL6085513 0.76 CEPT1 (0.58) CEPT1AGPAT2MAPTRXFP1TP53

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 6 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
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 2798/4885PTPN1 344/4885AGPAT2 3284/4885

“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.