SCHEMBL9569770

SCHEMBL9569770

C[Si](C)(C)c1cc2ccc(Br)cc2o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.44
APP P05067 1/20 0.42
PIM1 P11309 1/20 0.37
CYP2A6 P11509 2/20 0.35
MIF P14174 1/20 0.35
BACE1 P56817 2/20 0.34
MAOA P21397 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
NOS1 P29475 1/20 0.33
METAP2 P50579 1/20 0.33
DYRK1A Q13627 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 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
SCHEMBL7491461 0.75 APP (0.44) MAOBAPPPIM1CYP2A6MIF
SCHEMBL1655877 0.72 FLT3 (0.50) MAOBCYP2A6MAOAMEN1KMT2A
SCHEMBL13197119 0.72 NPC1 (0.56) MAOBAPPPIM1CYP2A6MIF
SCHEMBL16795610 0.72 ALDH1A1 (0.53) MAOBPIM1MIFMAOAMEN1
SCHEMBL19282095 0.71 MAOB (0.42) MAOBAPPPIM1CYP2A6MIF
SCHEMBL31031658 0.71 MAOB (0.42) MAOBAPPPIM1CYP2A6MIF
SCHEMBL2095773 0.71 MAOB (0.42) MAOBAPPPIM1CYP2A6MIF
SCHEMBL12278485 0.71 PIM1 (0.44) PIM1NPC1RAB9A
SCHEMBL5028081 0.71 FLT3 (0.65) MAOBPIM1MEN1KMT2ACYP1A2
SCHEMBL16403660 0.71 MCL1 (0.42) MAOBAPPCYP2A6MIFMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0560554-A2 Antitumor compositions and methods of treatment ELI LILLY AND COMPANY (US) 1993-09-15 EP disclosed
US-5169860-A Benzofuran or benzothiophene arylsulfonylureas ELI LILLY AND COMPANY (US) 1992-12-08 US disclosed