SCHEMBL7688488

SCHEMBL7688488

C[Si](C)(C)Oc1ccc(C(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.65
KMT2A Q03164 2/20 0.65
NPSR1 Q6W5P4 2/20 0.65
MEN1 O00255 1/20 0.65
MAPT P10636 1/20 0.65
MAPK1 P28482 1/20 0.65
RAB9A P51151 1/20 0.65
RXFP1 Q9HBX9 1/20 0.65
SRD5A2 P31213 1/20 0.49
ELANE P08246 6/20 0.46
LSS P48449 4/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
MAOB P27338 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL9339181 0.90 ELANE (0.53) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL3894497 0.84 CYP2A6 (0.42) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL9339629 0.83 ELANE (0.61) KMT2AMEN1MAPTRAB9ASRD5A2
SCHEMBL667750 0.82 CYP2A6 (0.40) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL7688132 0.81 MAPT (0.42) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL10676086 0.79 SRD5A2 (0.66) RAB9ASRD5A2ELANE
SCHEMBL1010096 0.79 RAB9A (1.00) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL10528634 0.78 MAPK1 (0.42) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL3842210 0.78 SRD5A2 (0.71) LMNAKMT2ANPSR1MEN1MAPT
SCHEMBL3844080 0.78 SRD5A2 (0.71) LMNAKMT2ANPSR1MEN1MAPT

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
US-6441177-B1 Tertiary amines HOFFMANN-LA ROCHE INC. 2002-08-27 US disclosed
EP-0778264-B1 Tertiary amines having antimycotic and cholesterol lowering activity HOFFMANN LA ROCHE (CH) 2001-07-11 EP disclosed
US-6034275-A FUGICIDES; ATICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 2000-03-07 US disclosed
EP-0778264-A1 Tertiary amines having antimycotic and cholesterol lowering activity F. HOFFMANN-LA ROCHE AG (CH) 1997-06-11 EP disclosed