SCHEMBL9430877

SCHEMBL9430877

Cc1ccc(-c2c(C(=O)Nc3ccccc3)oc3ccc(C)cc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.54
MAOB P27338 2/20 0.52
MAPT P10636 8/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
F12 P00748 1/20 0.50
KDM4E B2RXH2 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MMP2 P08253 1/20 0.48
MMP13 P45452 1/20 0.48

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
SCHEMBL9218384 0.93 TP53 (0.54) TP53MAOBMAPTSMN1; SMN2NPC1
SCHEMBL9217396 0.82 TP53 (0.71) TP53SMN1; SMN2HTTMEN1KMT2A
SCHEMBL9212323 0.81 L3MBTL1 (0.51) TP53MAOBMAPTSMN1; SMN2NPC1
SCHEMBL9430605 0.80 TP53 (0.71) TP53SMN1; SMN2NPC1RAB9AHTT
SCHEMBL8201626 0.80 L3MBTL1 (0.60) TP53MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9431339 0.78 POLB (0.66) TP53SMN1; SMN2HTTMEN1KMT2A
SCHEMBL9430103 0.78 TP53 (0.51) TP53SMN1; SMN2NPC1RAB9AHTT
SCHEMBL9430382 0.78 NPC1 (0.50) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL9212898 0.77 MAPT (0.48) TP53MAOBMAPTSMN1; SMN2NPC1
SCHEMBL9430417 0.77 TP53 (0.46) TP53MAPTSMN1; SMN2NPC1RAB9A

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
WO-1994026738-A1 N'-HETEROCYCLYL-N-BENZOFURANYL UREA DERIVATIVES AND THEIR ANALOGS AS ACAT INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed