SCHEMBL76472

SCHEMBL76472

N#C/C(=C1/Nc2ccc(C(=O)O)cc2N1)c1nccc(C(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SYK P43405 16/20 0.41
SMN1; SMN2 Q16637 1/20 0.34
KMO O15229 1/20 0.34
TAS2R14 Q9NYV8 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
SCHEMBL76473 1.00 SYK (0.41) SYKSMN1; SMN2KMOTAS2R14
SCHEMBL77856 0.84 SYK (0.39) SYKSMN1; SMN2KMO
SCHEMBL77857 0.84 SYK (0.39) SYKSMN1; SMN2KMO
SCHEMBL76946 0.82 SYK (0.39) SYKSMN1; SMN2TAS2R14
SCHEMBL76945 0.82 SYK (0.39) SYKSMN1; SMN2TAS2R14
SCHEMBL85787 0.82 SYK (0.39) SYKSMN1; SMN2TAS2R14
SCHEMBL77868 0.71 SYK (0.37) SYKSMN1; SMN2TAS2R14
SCHEMBL77867 0.71 SYK (0.37) SYKSMN1; SMN2TAS2R14
SCHEMBL86445 0.70 SYK (0.40) SYKSMN1; SMN2
SCHEMBL1578122 0.69 KMO (0.54) SYKKMOTAS2R14

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-8129396-B2 2-[1H-benzimidazol-2(3H)-ylidene]-2-(pyrimidin-2-yl)acetamides and 2-[benzothiazol-2(3H)-ylidene]-2-(pyrimidin-2-yl)acetamides as kinase inhibitors TELIK, INC. (US) 2012-03-06 US disclosed
US-20100081653-A1 2-[1H-Benzimidazol-2(3H)-ylidene]-2-(pyrimidin-2-yl)acetamides and 2-[benzothiazol-2(3H)-ylidene]-2-(pyrimidin-2-yl)acetamides as kinase inhibitors TELIK, INC. 2010-04-01 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-20100081653-A1 2-[1H-Benzimidazol-2(3H)-ylidene]-2-(pyrimidin-2-yl)acetamides and 2-[benzothiazol-2(3H)-ylidene]-2-(pyrimidin-2-yl)acetamides as kinase inhibitors MAP3K2, MAP4K2, MAP3K12 SYK 716/4885SMN1; SMN2 3379/4885KMO 1732/4885

“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.