SCHEMBL4418655

SCHEMBL4418655

CNc1c(C(=O)O)sc([S+](C)[O-])c1C#N

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 6/20 0.34
FNTB P49356 6/20 0.34
GRIA4 P48058 4/20 0.32
GRIA2 P42262 3/20 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
SCHEMBL9864787 0.73
SCHEMBL4412987 0.73 GRIA4 (0.55) FNTAFNTBGRIA4GRIA2
SCHEMBL4422079 0.72 GRIA4 (0.51) FNTAFNTBGRIA4GRIA2
SCHEMBL3401686 0.71 ALDH1A1 (0.41)
SCHEMBL9866329 0.70
SCHEMBL3138051 0.69 GRIA4 (0.65) FNTAFNTBGRIA4GRIA2
SCHEMBL9865077 0.68 KDM4E (0.32) FNTAFNTB
SCHEMBL16690053 0.68 GRIA2 (0.40) GRIA4GRIA2
SCHEMBL4417287 0.67 PIK3CA (0.58) GRIA4GRIA2
SCHEMBL9865502 0.66 ALDH1A1 (0.43)

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-20090325925-A1 Thiophenes and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-12-31 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-20090325925-A1 Thiophenes and uses thereof PIK3CA, JAK2, MTOR FNTA 3475/4885FNTB 3949/4885GRIA4 2350/4885

“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.