SCHEMBL1855922

SCHEMBL1855922

CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)Nc2c(C(N)=O)oc3ccc(Br)cc23)C1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.43
BACE1 P56817 5/20 0.43
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.40
ESR2 Q92731 1/20 0.39
MAPK10 P53779 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NR1H2 P55055 1/20 0.38
SCN9A Q15858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KRAS P01116 1/20 0.37
F12 P00748 2/20 0.37

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
SCHEMBL1852060 0.85 ESR2 (0.49) RAB9ABACE1KMT2AMEN1HPGD
SCHEMBL1853022 0.78 BACE1 (0.42) RAB9ABACE1KMT2AMEN1HPGD
SCHEMBL4431903 0.77 ALDH1A1 (0.42) RAB9AKMT2AMEN1HPGDALDH1A1
SCHEMBL1851581 0.77 NPC1 (0.51) RAB9ABACE1KMT2AMEN1HPGD
SCHEMBL1849293 0.77 BACE1 (0.50) BACE1KMT2AMEN1HPGDALDH1A1
SCHEMBL1850058 0.76 ALDH1A1 (0.48) RAB9ABACE1KMT2AMEN1HPGD
SCHEMBL4787883 0.75 NR1H2 (0.54) KDM4EMAPTESR2NR1H2SCN9A
SCHEMBL1851649 0.74 USP30 (0.47) RAB9ABACE1KMT2AMEN1HPGD
SCHEMBL1854752 0.74 USP30 (0.47) RAB9ABACE1KMT2AMEN1HPGD
SCHEMBL10197664 0.74 CARM1 (0.53) RAB9AMAPTESR2NR1H2SCN9A

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 4 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
EP-2097419-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS Exelixis, Inc. (US) 2009-09-09 EP disclosed
WO-2009086264-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS, INC. (US) 2009-07-09 WO 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 RAB9A 1026/4885BACE1 3392/4885KMT2A 2152/4885

“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.