SCHEMBL10291349

SCHEMBL10291349

C/C=C(C(=O)O)\C(=C/C)[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 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
SCHEMBL6369262 0.82 — —
SCHEMBL6369258 0.82 — —
SCHEMBL18055629 0.80 PPARG (0.31) —
SCHEMBL10290622 0.72 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL10499893 0.70 — —
SCHEMBL10499910 0.70 — —
SCHEMBL216025 0.69 — —
SCHEMBL31281832 0.68 GRIK1 (0.35) SMN1; SMN2
SCHEMBL17674106 0.67 SMN1; SMN2 (0.51) SMN1; SMN2
SCHEMBL17674104 0.67 SMN1; SMN2 (0.51) SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365517-B2 3-cyano-quinoline derivatives with antiproliferative activity JANSSEN PHARMACEUTICA NV (BE) 2016-06-14 — — US disclosed
US-20140256948-A1 3-CYANO-QUINOLINE DERIVATIVES WITH ANTIPROLIFERATIVE ACTIVITY JANSSEN PHARMACEUTICA NV (BE) 2014-09-11 — — US disclosed
EP-1824856-B1 2,4 (4,6) PYRIMIDINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-10-23 — — EP disclosed
EP-1633365-B1 MACROCYCLIC QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS JANSSEN PHARMACEUTICA NV (BE) 2012-02-08 — — EP disclosed
EP-2305687-A1 Quinazoline derivatives Janssen Pharmaceutica NV (BE) 2011-04-06 — — EP disclosed
EP-1696914-B1 3-CYANO-QUINOLINE DERIVATIVES WITH ANTIPROLIFERATIVE ACTIVITY JANSSEN PHARMACEUTICA NV (BE) 2009-10-28 — — EP disclosed
EP-1697384-B1 PYRIDO- AND PYRIMIDOPYRIMIDINE DERIVATIVES AS ANTI-PROLIFERATIVE AGENTS JANSSEN PHARMACEUTICA NV (BE) 2008-04-02 — — EP 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-20140256948-A1 3-CYANO-QUINOLINE DERIVATIVES WITH ANTIPROLIFERATIVE ACTIVITY NR1H3, NR1H2, NR1D1 SMN1; SMN2 4637/4885

“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.

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