SCHEMBL4876592

SCHEMBL4876592

O=C(O)c1cc2c(s1)c(C1CCCCC1)c(-c1ccc3nc(-c4c(F)cccc4F)ccc3c1)n2CC(=O)N1CCSC1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
DPP7 Q9UHL4 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
SCHEMBL4868332 0.93 ALDH1A1 (0.37) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4875667 0.91 SMO (0.33) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877463 0.89 GAA (0.36) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4876599 0.88 DPP4 (0.33) DPP4DPP7
SCHEMBL4879010 0.88 KCNH2 (0.34) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4872621 0.87 ALDH1A1 (0.31) DPP4ALDH1A1
SCHEMBL4876571 0.86 KCNH2 (0.37)
SCHEMBL4877464 0.86 CYP2D6 (0.34)
SCHEMBL4877145 0.85 GRIN2B (0.37) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4876257 0.85 ALDH1A1 (0.34) ALDH1A1GAAKMT2ASMN1; 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 2 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

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 DPP4 191/4885ALDH1A1 1357/4885GAA 66/4885

“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.