SCHEMBL4876355

SCHEMBL4876355

CN(C)C(=O)Cn1c(-c2ccc3nc(-c4cccc(F)c4)ccc3c2)c(-c2ccccc2)c2sc(C(=O)O)cc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 8/20 0.39
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGER1 P34995 1/20 0.34
MAP4K4 O95819 1/20 0.34
ALOX5AP P20292 1/20 0.34
CFTR P13569 1/20 0.33
KMO O15229 1/20 0.33
GRIN1 Q05586 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
SCHEMBL4877469 0.91 GRIN2B (0.35) GRIN2BGRIN1
SCHEMBL4873965 0.90 GRIN2B (0.41) GRIN2BMEN1KMT2AKMOGRIN1
SCHEMBL4876346 0.87 GRIN2B (0.35) GRIN2B
SCHEMBL4878159 0.85 KCNH2 (0.34) GRIN2B
SCHEMBL4874257 0.84 GRIN2B (0.34) GRIN2BGRIN1
SCHEMBL4873278 0.84 GRIN1 (0.37) GRIN2BMEN1KMT2AALOX5APKMO
SCHEMBL4874611 0.84 MKNK2 (0.37) GRIN2BMEN1KMT2A
SCHEMBL4878281 0.83 KCNH2 (0.37)
SCHEMBL4876791 0.81 GAA (0.39) GRIN2BKMT2A
SCHEMBL2997718 0.80 GRIN2B (0.40) GRIN2BPTGER1GRIN1

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-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 GRIN2B 3420/4885MEN1 4834/4885KMT2A 4254/4885

“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.