SCHEMBL5020344

SCHEMBL5020344

CSc1nccc(/C(C)=N/OCCCc2cc(C)nc(-c3cccc(C)n3)n2)n1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 19/20 0.34
TGFBR1 P36897 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
SCHEMBL5020347 0.87 TGFBR1 (0.36) FFAR1TGFBR1
SCHEMBL5020230 0.85 FFAR1 (0.31) FFAR1
SCHEMBL5020228 0.84 FFAR1 (0.41) FFAR1TGFBR1
SCHEMBL5020448 0.84 HSP90AA1 (0.34)
SCHEMBL5020348 0.83 TGFBR1 (0.34) FFAR1TGFBR1
SCHEMBL5020229 0.82 TGFBR1 (0.34) FFAR1TGFBR1
SCHEMBL15465604 0.82 GRM5 (0.34)
SCHEMBL15465601 0.82 GRM5 (0.34)
SCHEMBL5020221 0.82 GRM5 (0.34)
SCHEMBL5020443 0.82 HSP90AA1 (0.35) FFAR1TGFBR1

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-20140045873-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-02-13 US disclosed
US-20140045873-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-02-13 US disclosed
WO-2012062844-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-05-18 WO 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-20140045873-A1 NOVEL MICROBIOCIDES MSR1, CD209, C3AR1 FFAR1 629/4885TGFBR1 1875/4885

“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.