SCHEMBL4482969

SCHEMBL4482969

Fc1cc(Br)ccc1N1CCc2c(Cl)ncnc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.39
ROCK1 Q13464 1/20 0.38
EIF4E P06730 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
HSP90B1 P14625 1/20 0.37
TRAP1 Q12931 1/20 0.37
CYP2C9 P11712 1/20 0.36
HTT P42858 1/20 0.36
MAP3K14 Q99558 1/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL4503148 0.86 HTT (0.36) GPR119EIF4EMKNK1MKNK2CYP2C9
SCHEMBL12170572 0.86 EIF4E (0.46) GPR119ROCK1EIF4EMKNK1MKNK2
SCHEMBL4494380 0.80 ALDH1A1 (0.39) GPR119EIF4EMKNK1MKNK2HTT
SCHEMBL375962 0.79 GPR119 (0.61) GPR119CYP2C9
SCHEMBL4492509 0.79 HTT (0.40) GPR119CYP2C9HTT
SCHEMBL4491806 0.77 GPR119 (0.37) GPR119HTTEGFR
SCHEMBL4487002 0.72 GPR119 (0.53) GPR119CYP2C9
SCHEMBL4497686 0.69 HTT (0.37) GPR119ROCK1EIF4EMKNK1MKNK2
SCHEMBL30964509 0.69 EGFR (0.52) ROCK1EIF4EMKNK1MKNK2CYP2C9
SCHEMBL4502152 0.69 P2RX7 (0.38) HTTEGFR

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
US-8222261-B2 Chemical compounds GlaxoSmithKline, LLC (US) 2012-07-17 US disclosed
US-20090318477-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2009-12-24 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-20090318477-A1 CHEMICAL COMPOUNDS GPR119, GOT2, SLC5A2 GPR119 1/4885ROCK1 3485/4885EIF4E 3779/4885

“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.