SCHEMBL7215552

SCHEMBL7215552

O=C(O)c1cccc(-c2nc(-c3ccc(Cl)cc3)cs2)c1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.73
RAB9A P51151 5/20 0.73
NPC1 O15118 4/20 0.73
SMN1; SMN2 Q16637 4/20 0.73
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
EIF4E P06730 8/20 0.60
CYP19A1 P11511 3/20 0.58
ALDH1A1 P00352 1/20 0.58
CRHBP P24387 1/20 0.57
CRHR2 Q13324 1/20 0.57
CTRC Q99895 1/20 0.55
LMNA P02545 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
SCHEMBL6197531 0.96 KDM4E (0.75) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL12171802 0.91 CYP19A1 (0.67) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL28075899 0.88 KDM4E (0.79) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL17336823 0.88 KDM4E (0.64) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL12171986 0.87 KDM4E (0.64) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL1505287 0.87 SREBF2 (0.65) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL12796866 0.86 KDM4E (0.63) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL1505212 0.86 NPC1 (0.60) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL7215075 0.86 KDM4E (0.60) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL12871690 0.85 EIF4E (0.64) KDM4ERAB9ANPC1SMN1; SMN2MEN1

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-6545009-B1 Imidazole, oxazole and thiazole derivatives for regulation of peroxisome proliferator-activated receptor function; improving insulin resistance, treating impaired glucose tolerance and obesity, enhancing insulin sensitivity, etc. TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-04-08 US disclosed
EP-1092711-A1 RETINOID-ASSOCIATED RECEPTOR REGULATORS Takeda Chemical Industries, Ltd. (JP) 2001-04-18 EP disclosed