SCHEMBL4876388

SCHEMBL4876388

O=C(O)c1cc2c(s1)c(C1CCCC1)c(-c1ccc3nc(-c4cccc(OC(F)(F)F)c4)ccc3c1)n2Cc1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 9/20 0.38
GCGR P47871 1/20 0.37
GIPR P48546 1/20 0.37
MDM2 Q00987 2/20 0.36
PTGES O14684 1/20 0.35
RIPK3 Q9Y572 1/20 0.34
DYRK1A Q13627 2/20 0.34
CLK2 P49760 1/20 0.34
HASPIN Q8TF76 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
STK17B O94768 1/20 0.33

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
SCHEMBL4867728 0.90 ALOX5AP (0.41) ALOX5APGCGRGIPRPTGESDYRK1A
SCHEMBL4877910 0.89 ALOX5AP (0.36) ALOX5APGCGRGIPRPDE4APDE4B
SCHEMBL4873267 0.89 ALOX5AP (0.34) ALOX5APMDM2DYRK1A
SCHEMBL4866901 0.86 GRIN1 (0.33) ALOX5APMDM2
SCHEMBL4879012 0.85 ALOX5AP (0.35) ALOX5APRIPK3
SCHEMBL4875175 0.85 ERCC5 (0.38) ALOX5AP
SCHEMBL4867590 0.85 ALOX5AP (0.35) ALOX5APMDM2
SCHEMBL4877200 0.84 KDM4E (0.33) ALOX5APGCGRGIPR
SCHEMBL4872012 0.83 MDM2 (0.35) ALOX5APMDM2PDE4APDE4BPDE4C
SCHEMBL4867002 0.83 IRAK4 (0.35) ALOX5APGCGRGIPR

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-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 ALOX5AP 3943/4885GCGR 3161/4885GIPR 2444/4885

“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.