SCHEMBL5046042

SCHEMBL5046042

CC(=O)c1ccc(OCCOc2c(-c3ccc(F)cc3)n(C)c3ccccc3c2=O)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.43
SYK P43405 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPSR1 Q6W5P4 1/20 0.39
PKM P14618 1/20 0.39
PLA2G2A P14555 1/20 0.39
ATM Q13315 1/20 0.38
WDR5 P61964 1/20 0.38
HTT P42858 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL4222018 0.92 L3MBTL1 (0.42) BRD4SYKL3MBTL1PKMPLA2G2A
SCHEMBL4220227 0.88 BRD4 (0.44) BRD4SYKL3MBTL1NPSR1PLA2G2A
SCHEMBL4220932 0.87 HTT (0.46) BRD4L3MBTL1NPSR1WDR5HTT
SCHEMBL5044656 0.84 BRD4 (0.36) BRD4L3MBTL1NPSR1PKMPLA2G2A
SCHEMBL5044658 0.84 BRD4 (0.36) BRD4L3MBTL1NPSR1PKMPLA2G2A
SCHEMBL4213424 0.84 L3MBTL1 (0.42) BRD4L3MBTL1PKMPLA2G2AHTT
SCHEMBL5048604 0.84 HTT (0.45) BRD4L3MBTL1NPSR1WDR5HTT
SCHEMBL4210774 0.83 MAOB (0.47) BRD4NPSR1HTT
SCHEMBL14011412 0.83 BRD4 (0.35) BRD4L3MBTL1NPSR1PKMPLA2G2A
SCHEMBL4208245 0.82 BRD4 (0.42) BRD4NPSR1PKMATMWDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456288-B2 Heterocyclic compounds and methods of making and using thereof REDDY US THERAPEUTICS, INC. (US) 2008-11-25 US disclosed
US-20050119269-A1 Heterocyclic compounds and methods of making and using thereof DR. REDDY'S LABORATORIES LTD. (IN) 2005-06-02 US disclosed
WO-2005040163-A1 HETEROCYCLIC COMPOUNDS THAT BLOCK THE EFFECTS OF ADVANCED GLYCATION END PRODUCTS (AGE) DR. REDDY'S LABORATORIES LTD (IN) 2005-05-06 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-20050119269-A1 Heterocyclic compounds and methods of making and using thereof PYGM, MYLK, HMOX1 BRD4 784/4885SYK 1773/4885L3MBTL1 4807/4885

“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.