SCHEMBL14437237

SCHEMBL14437237

O=C1N=C(N[C@@H](CO)c2ccccc2)S/C1=C\c1ccc2nccc(N3CCOCC3)c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPK1 P28482 3/20 0.37
MAPT P10636 6/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
PIK3CD O00329 1/20 0.35
GAK O14976 1/20 0.35
RPS6KA4 O75676 1/20 0.35
STK10 O94804 1/20 0.35
PIM1 P11309 1/20 0.35
CSNK2A2 P19784 1/20 0.35
MAP2K2 P36507 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
MTOR P42345 1/20 0.35
CSNK1D P48730 1/20 0.35
PIK3CG P48736 1/20 0.35
CLK1 P49759 1/20 0.35

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
SCHEMBL5504200 0.88 MAPK1 (0.36) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL14437205 0.81 EGFR (0.39) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL13898543 0.80 MEN1 (0.42) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL13233381 0.80 MEN1 (0.42) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL14437230 0.80 MEN1 (0.38) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL2993546 0.79 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL2993549 0.79 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL14437241 0.79 ALDH1A1 (0.43) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL4871699 0.78 CDK1 (0.49) MEN1KMT2AMAPK1MAPTALDH1A1
SCHEMBL4866405 0.78 CDK1 (0.49) MEN1KMT2AMAPK1MAPTALDH1A1

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
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed