SCHEMBL1851606

SCHEMBL1851606

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1c(C(N)=O)oc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
KDM4E B2RXH2 2/20 0.59
TSHR P16473 2/20 0.59
HTT P42858 1/20 0.59
NPC1 O15118 1/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
LMNA P02545 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
USP30 Q70CQ3 1/20 0.48
JAK2 O60674 1/20 0.47
HSD17B10 Q99714 1/20 0.46
EPHX2 P34913 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TEAD1 P28347 1/20 0.44
YAP1 P46937 1/20 0.44
TEAD4 Q15561 1/20 0.44
TEAD2 Q15562 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL1851819 0.87 USP30 (0.53) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL1850141 0.87 USP30 (0.53) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL1855333 0.87 NPSR1 (0.49) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL1849965 0.87 NPSR1 (0.49) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL1854752 0.81 USP30 (0.47) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL1851649 0.81 USP30 (0.47) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL3343831 0.77 KDM4E (0.59) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL3343836 0.77 KDM4E (0.59) ALDH1A1KDM4ETSHRHTTNPC1
SCHEMBL28153247 0.76 LMNA (0.67) ALDH1A1KDM4ETSHRNPC1MEN1
SCHEMBL18485519 0.76 LMNA (0.67) ALDH1A1KDM4ETSHRNPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 EP disclosed
US-20090247559-A1 Benzofuropyrimidinones EXELIXIS, INC. (US) 2009-10-01 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-20090247559-A1 Benzofuropyrimidinones F12, BRI3BP, BRD1 ALDH1A1 315/4885KDM4E 1855/4885TSHR 1203/4885

“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.