SCHEMBL1856586

SCHEMBL1856586

CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H]1C(=O)Nc1c(C(N)=O)oc2ccc(Br)cc12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
CFD P00746 6/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
KDM4E B2RXH2 3/20 0.38
TSHR P16473 3/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.38
USP30 Q70CQ3 1/20 0.37
NPSR1 Q6W5P4 1/20 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
SCHEMBL1855450 1.00 KMT2A (0.43) KMT2AMAPTCYP1A2POLBCYP3A4
SCHEMBL1855448 1.00 KMT2A (0.43) KMT2AMAPTCYP1A2POLBCYP3A4
SCHEMBL1859907 0.91 CYP1A2 (0.51) KMT2AMAPTCYP1A2POLBCYP3A4
SCHEMBL1852389 0.91 CYP1A2 (0.51) KMT2AMAPTCYP1A2POLBCYP3A4
SCHEMBL1852387 0.91 CYP1A2 (0.51) KMT2AMAPTCYP1A2POLBCYP3A4
SCHEMBL1855587 0.90 KDM4E (0.51) KMT2ACYP1A2POLBCYP3A4CYP2C19
SCHEMBL1853806 0.90 KDM4E (0.51) KMT2ACYP1A2POLBCYP3A4CYP2C19
SCHEMBL1853808 0.90 KDM4E (0.51) KMT2ACYP1A2POLBCYP3A4CYP2C19
SCHEMBL1851790 0.89 CFD (0.43) KMT2AMAPTCYP1A2POLBCYP3A4
SCHEMBL1851107 0.89 CFD (0.43) KMT2AMAPTCYP1A2POLBCYP3A4

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 KMT2A 2152/4885MAPT 1941/4885CYP1A2 453/4885

“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.