SCHEMBL4747443

SCHEMBL4747443

CCCN(CCC)S(=O)(=O)c1ccc(CC(C)(C)C(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAPK1 P28482 4/20 0.51
KDM4E B2RXH2 2/20 0.51
USP2 O75604 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
MAPT P10636 4/20 0.50
KCNQ1 P51787 2/20 0.49
ALDH1A1 P00352 2/20 0.48
ROCK1 Q13464 2/20 0.48
APP P05067 1/20 0.48
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
ROCK2 O75116 1/20 0.47
GSTO1 P78417 1/20 0.46
TAS2R14 Q9NYV8 1/20 0.45

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
SCHEMBL4749988 0.93 RAB9A (0.52) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4750272 0.88 MAPT (0.53) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4747401 0.84 MAPT (0.67) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4749602 0.84 KDM4E (0.72) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4749582 0.84 KDM4E (0.72) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4747484 0.80 PARP1 (0.58) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4747486 0.80 PARP1 (0.58) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4747488 0.80 PARP1 (0.58) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4749789 0.80 KDM4E (0.71) LMNARAB9ASMN1; SMN2MAPK1KDM4E
SCHEMBL4750368 0.80 LMNA (0.52) LMNARAB9ASMN1; SMN2MAPK1KDM4E

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
WO-2008124000-A2 THIAZOLE DERIVATIVES AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2008-10-16 WO claimed
WO-2008124000-A2 THIAZOLE DERIVATIVES AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2008-10-16 WO disclosed