SCHEMBL4749598

SCHEMBL4749598

CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2nc(-c3ccc(C)cc3)cs2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
GLA P06280 1/20 0.66
KDM4E B2RXH2 4/20 0.65
HPGD P15428 3/20 0.65
TSHR P16473 2/20 0.65
USP2 O75604 1/20 0.65
MAPK1 P28482 1/20 0.65
ALDH1A1 P00352 3/20 0.60
RAB9A P51151 1/20 0.58
PHGDH O43175 6/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
MAPT P10636 2/20 0.57
POLB P06746 1/20 0.56
TP53 P04637 1/20 0.55
CASP1 P29466 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HTT P42858 1/20 0.55
STAT3 P40763 1/20 0.54

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
SCHEMBL4749947 0.91 KDM4E (0.64) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL4749926 0.89 KDM4E (0.74) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL4750033 0.89 KDM4E (0.62) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL4750786 0.88 KDM4E (0.61) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL235190 0.84 KDM4E (0.70) LMNASMN1; SMN2KDM4EHPGDMAPK1
SCHEMBL17073176 0.84 ALDH1A1 (0.62) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL4747451 0.83 KDM4E (0.67) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL4746848 0.82 KDM4E (0.82) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL17073178 0.82 LMNA (0.64) LMNASMN1; SMN2GLAKDM4EHPGD
SCHEMBL4749582 0.81 KDM4E (0.72) LMNASMN1; SMN2GLAKDM4EHPGD

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