SCHEMBL7104626

SCHEMBL7104626

COc1cc(NC(=O)Nc2ccc(Sc3ccc4[nH]c(NC(=O)O)nc4c3)cc2)cc(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 2/20 0.49
NR1I2 O75469 1/20 0.49
CYP1A2 P05177 1/20 0.49
MAPK14 Q16539 1/20 0.49
KDR P35968 8/20 0.47
TEK Q02763 6/20 0.47
MMP1 P03956 1/20 0.47
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
RAB9A P51151 1/20 0.46
VSIG8 P0DPA2 1/20 0.43
POLB P06746 1/20 0.41
PDGFRA P16234 1/20 0.41
NTRK1 P04629 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL5345802 0.92 LMNA (0.57) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL14375459 0.84 LMNA (0.69) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL7012558 0.83 KDR (0.55) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL7013839 0.82 KDR (0.54) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL7102856 0.80 MEN1 (0.47) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL5348784 0.79 KDR (0.67) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL6235584 0.79 LMNA (0.62) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL11879658 0.79 LMNA (0.66) MEN1KMT2ALMNANR1I2CYP1A2
SCHEMBL7097935 0.78 MEN1 (0.53) MEN1KMT2AMAPK14KDRRAB9A
SCHEMBL26115475 0.78 USP2 (0.54) MEN1KMT2ALMNANR1I2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341771-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2003-09-10 EP claimed
WO-2002044156-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2002-06-06 WO claimed
EP-1341771-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2003-09-10 EP disclosed
WO-2002044156-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2002-06-06 WO disclosed