SCHEMBL4879101

SCHEMBL4879101

Cc1csc(-c2ccc3cc(-c4c(C5CCCCC5)c5sc(C(=O)O)cc5n4CC(=O)N4CCC(O)CC4)ccc3n2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 9/20 0.35
ALDH1A1 P00352 2/20 0.31
SMO Q99835 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL4871879 0.95 GRIN2B (0.39) GRIN2BALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877120 0.91 ALDH1A1 (0.34) GRIN2BALDH1A1SMOGAAKMT2A
SCHEMBL4879113 0.89 GRIN2B (0.34) GRIN2BSMOLMNA
SCHEMBL4868308 0.87 KCNH2 (0.38) GRIN2BALDH1A1SMOGAAKMT2A
SCHEMBL4866862 0.86 KMT2A (0.36) GRIN2BALDH1A1KMT2A
SCHEMBL4877361 0.86 KCNH2 (0.37) GRIN2BALDH1A1SMOGAAKMT2A
SCHEMBL4868456 0.86 ALDH1A1 (0.39) GRIN2BALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4872088 0.86 KMT2A (0.36) ALDH1A1GAAKMT2ASMN1; SMN2LMNA
SCHEMBL4878001 0.85 ALDH1A1 (0.34) ALDH1A1SMOGAAKMT2ASMN1; SMN2
SCHEMBL4875667 0.85 SMO (0.33) GRIN2BALDH1A1SMOGAAKMT2A

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 1357/4885SMO 4550/4885

“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.