SCHEMBL7324912

SCHEMBL7324912

COCCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(C(=O)OC)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.68
RAB9A P51151 3/20 0.60
GAA P10253 1/20 0.54
L3MBTL1 Q9Y468 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
LMNA P02545 3/20 0.51
KMT2A Q03164 2/20 0.51
HTT P42858 2/20 0.51
HSP90AA1 P07900 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MEN1 O00255 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MMP1 P03956 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL7336081 1.00 MAPT (0.68) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7325780 1.00 MAPT (0.68) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7322722 0.96 MAPT (0.62) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL6132720 0.94 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL10295289 0.94 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7324122 0.94 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL6132617 0.94 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL15693338 0.92 MAPT (0.79) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL6539579 0.91 MAPT (0.64) MAPTRAB9ALMNAKMT2AHTT
SCHEMBL7339228 0.91 MAPT (0.64) MAPTRAB9ALMNAKMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed