SCHEMBL2169942

SCHEMBL2169942

C[Si](C)(C)C#Cc1ccc(S(=O)(=O)N2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
PKM P14618 5/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 4/20 0.44
GAA P10253 5/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
YAP1 P46937 1/20 0.43
TEAD4 Q15561 1/20 0.43
TEAD2 Q15562 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MDM2 Q00987 1/20 0.42
POLB P06746 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
SCHEMBL711933 0.83 TGM2 (0.58) PKMSMN1; SMN2POLB
SCHEMBL6744907 0.77 KMT2A (0.70) KMT2APKMALDH1A1GAAMEN1
SCHEMBL6744239 0.75 ALDH1A1 (0.71) KMT2APKMALDH1A1GAALMNA
SCHEMBL1870003 0.74 PKM (0.55) KMT2APKMALDH1A1GAAMEN1
SCHEMBL4003507 0.74 ALDH1A1 (0.53) KMT2APKMALDH1A1GAAMEN1
SCHEMBL20502397 0.74 ALDH1A1 (0.54) KMT2APKMALDH1A1GAAMEN1
SCHEMBL5443874 0.74 GPR183 (0.63) KMT2APKMALDH1A1LMNA
SCHEMBL5915285 0.74 LMNA (0.70) KMT2APKMSMN1; SMN2ALDH1A1MEN1
SCHEMBL19858517 0.73 PKM (0.76) PKMSMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL22558460 0.73 LMNA (0.43) SMN1; SMN2ALDH1A1LMNAL3MBTL1POLB

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-2346807-A1 NAPHTHYLACETIC ACIDS F. Hoffmann-La Roche AG (CH) 2011-07-27 EP disclosed
WO-2010055005-A1 NAPHTHYLACETIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 2010-05-20 WO disclosed