SCHEMBL419357

SCHEMBL419357

N#Cc1cccc(-c2oc(C(=O)N3CCNC(=O)C3)cc2-c2cc(F)cc(Cl)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.36
EIF4A3 P38919 3/20 0.36
SCN9A Q15858 1/20 0.35
HSP90AA1 P07900 1/20 0.35
KCNK3 O14649 5/20 0.35
NTRK1 P04629 1/20 0.34
UTS2R Q9UKP6 1/20 0.34
PARP1 P09874 2/20 0.34
PARP2 Q9UGN5 1/20 0.34
PDE4B Q07343 2/20 0.33
PGR P06401 1/20 0.33
CSNK1E P49674 1/20 0.33
SLC6A7 Q99884 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
SCHEMBL421343 0.94 PGR (0.39) EIF4A3SCN9AHSP90AA1NTRK1PARP1
SCHEMBL415935 0.92 METAP2 (0.35) METAP2EIF4A3KCNK3UTS2RPGR
SCHEMBL421270 0.91 PDE4B (0.40) HSP90AA1NTRK1PARP1PARP2PDE4B
SCHEMBL460246 0.91 EIF4A3 (0.40) EIF4A3SCN9AHSP90AA1UTS2RPARP1
SCHEMBL418318 0.89 PDE4B (0.41) HSP90AA1NTRK1PARP1PARP2PDE4B
SCHEMBL417758 0.86 PGR (0.40) EIF4A3PDE4BPGRCSNK1E
SCHEMBL418233 0.85 HSP90AA1 (0.40) HSP90AA1NTRK1PARP1PARP2
SCHEMBL455596 0.83 PDE4B (0.37) SCN9AHSP90AA1NTRK1PARP1PARP2
SCHEMBL417405 0.83 DPP4 (0.41) METAP2EIF4A3UTS2RPDE4BCSNK1E
SCHEMBL419600 0.83 PDE4B (0.44) HSP90AA1PARP1PDE4B

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376479-B1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO KG (DE) 2016-03-02 EP disclosed
EP-2376479-B1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO KG (DE) 2016-03-02 EP disclosed
US-8324268-B2 Substituted furancarboxamides, and use thereof AICURIS GMBH & CO. KG (DE) 2012-12-04 US disclosed
US-8324268-B2 Substituted furancarboxamides, and use thereof AICURIS GMBH & CO. KG (DE) 2012-12-04 US disclosed
US-8324268-B2 Substituted furancarboxamides, and use thereof AICURIS GMBH & CO. KG (DE) 2012-12-04 US disclosed
US-20120022059-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2012-01-26 US disclosed
US-20120022059-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2012-01-26 US disclosed
US-20120022059-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2012-01-26 US disclosed
WO-2010075957-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2010-07-08 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-20120022059-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AADAC, DDC, TPMT METAP2 549/4885EIF4A3 2020/4885SCN9A 3972/4885

“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.