SCHEMBL3824754

SCHEMBL3824754

C=CCN(CC=C)c1ccc(-c2nc(-c3ccccc3/C=C/C(=O)OC)[nH]c2-c2ccc(F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 8/20 0.41
▸ MAPK14 Q16539 4/20 0.41
▸ MAPK13 O15264 3/20 0.41
▸ GCGR P47871 3/20 0.41
▸ MAPK12 P53778 3/20 0.41
▸ MAPK11 Q15759 3/20 0.41
▸ CSNK1D P48730 1/20 0.41
▸ CSNK1E P49674 1/20 0.41
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ POLB P06746 2/20 0.39
▸ NOX1 Q9Y5S8 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL6608185 0.71 RAF1 (0.43) ALOX5MAPK14MAPK13GCGRMAPK12
SCHEMBL3824756 0.71 SELP (0.40) MAPTMEN1KMT2APOLBKDM4E
SCHEMBL3824090 0.70 SELP (0.41) MAPTMEN1KMT2APOLBKDM4E
SCHEMBL3829650 0.69 RAF1 (0.39) ALOX5MEN1KMT2APOLBKDM4E
SCHEMBL8486213 0.66 MAPK14 (0.72) ALOX5MAPK14MAPK13GCGRMAPK12
SCHEMBL7087374 0.65 ALOX5 (0.62) ALOX5MAPK14MAPK11CSNK1DCSNK1E
SCHEMBL32673048 0.65 PTPN1 (0.52) ALOX5MAPK14MAPK13GCGRMAPK12
SCHEMBL18843373 0.63 MAPT (0.57) ALOX5MAPK14MAPK13GCGRMAPK12
SCHEMBL22161378 0.63 TUBB4A (0.49) MAPTMEN1KMT2A
SCHEMBL18750608 0.63 MGAM (0.61) MAPK14MAPK13GCGRMAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0999835-B1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS TAIJI BIOMEDICAL INC (US) 2009-09-09 — — EP disclosed
EP-2082740-A2 Use of imidazole derivatives as MDR modulators Taiji Biomedical, Inc. (US) 2009-07-29 — — EP disclosed
EP-0999835-A4 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORP (US) 2004-08-25 — — EP disclosed
EP-0999835-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS Ontogen Corporation (US) 2000-05-17 — — EP disclosed
WO-1999002155-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORPORATION (US) 1999-01-21 — — WO disclosed
US-5840721-A INCREASE SENSITIVITY OF MULTIDRUG RESISTANT TUMOR CELLS TO ANTICANCER AGENTS ONTOGEN CORPORATION (US) 1998-11-24 — — US disclosed
Send feedback