SCHEMBL4128711

SCHEMBL4128711

NC(=O)c1oc2ccc(Br)cc2c1NC(=O)[C@@H]1CCN1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
HPGD P15428 2/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 4/20 0.45
TSHR P16473 4/20 0.45
HTT P42858 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 2/20 0.43
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CASP6 P55212 1/20 0.39
MCHR1 Q99705 1/20 0.39
ADORA2A P29274 1/20 0.38
CASP1 P29466 1/20 0.38

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
SCHEMBL4115321 0.94 ALDH1A1 (0.46) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL1854752 0.86 USP30 (0.47) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL1851649 0.86 USP30 (0.47) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL4273196 0.85 KMT2A (0.44) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL4105160 0.85 KMT2A (0.44) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL1852384 0.84 KMT2A (0.43) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL4280778 0.83 KMT2A (0.45) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL4119304 0.83 KMT2A (0.46) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL1852526 0.82 CYP3A4 (0.48) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL1850141 0.80 USP30 (0.53) ALDH1A1KMT2AMAPTKDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 315/4885HPGD 2284/4885KMT2A 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.