SCHEMBL4871879

SCHEMBL4871879

Cc1csc(-c2ccc3cc(-c4c(C5CCCCC5)c5sc(C(=O)O)cc5n4CC(=O)N4CCCCC4)ccc3n2)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 10/20 0.39
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.32
GRIN1 Q05586 1/20 0.32
MAPT P10636 2/20 0.32

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
SCHEMBL4879101 0.95 GRIN2B (0.35) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4868456 0.91 ALDH1A1 (0.39) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4877300 0.88 GRIN2B (0.41) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4871889 0.88 GRIN2B (0.41) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4868731 0.87 GRIN2B (0.36) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4876718 0.87 ALDH1A1 (0.39) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4875238 0.87 ALDH1A1 (0.39) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4876216 0.87 KCNH2 (0.39) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4874030 0.87 KCNH2 (0.39) GRIN2BALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL4871957 0.86 ALDH1A1 (0.35) GRIN2BALDH1A1KMT2AGAASMN1; SMN2

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 GRIN2B 3420/4885ALDH1A1 1357/4885KMT2A 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.