SCHEMBL4746906

SCHEMBL4746906

CCCCCCN(CCCCCC)S(=O)(=O)c1ccc(C(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.68
RAB9A P51151 2/20 0.68
MAPK1 P28482 5/20 0.67
TSHR P16473 2/20 0.67
USP2 O75604 1/20 0.67
HPGD P15428 1/20 0.67
ADORA3 P0DMS8 1/20 0.60
LMNA P02545 8/20 0.59
SMN1; SMN2 Q16637 7/20 0.59
MAPT P10636 7/20 0.59
ALDH1A1 P00352 4/20 0.59
HTT P42858 2/20 0.59
MEN1 O00255 6/20 0.57
KMT2A Q03164 6/20 0.57
NPSR1 Q6W5P4 2/20 0.54
RXFP1 Q9HBX9 1/20 0.54
AVPR1B P47901 1/20 0.52
PHGDH O43175 2/20 0.51
F2 P00734 1/20 0.51
GLA P06280 1/20 0.51

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
SCHEMBL4750237 0.99 KDM4E (0.69) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4749789 0.96 KDM4E (0.71) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4749582 0.94 KDM4E (0.72) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4749602 0.94 KDM4E (0.72) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4747466 0.93 KDM4E (0.66) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4749908 0.92 KDM4E (0.67) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4749926 0.90 KDM4E (0.74) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4787619 0.85 KDM4E (0.66) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL14042335 0.83 KDM4E (0.59) KDM4ERAB9AMAPK1TSHRUSP2
SCHEMBL4749907 0.82 KDM4E (0.66) KDM4ERAB9AMAPK1TSHRUSP2

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 3 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
WO-2008124000-A2 THIAZOLE DERIVATIVES AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2008-10-16 WO disclosed