SCHEMBL7215841

SCHEMBL7215841

Cc1cc(-c2csc(-c3cccc(C(=O)O)c3)n2)c(C)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 7/20 0.49
SMN1; SMN2 Q16637 8/20 0.49
KDM4E B2RXH2 6/20 0.49
RAB9A P51151 6/20 0.49
NPC1 O15118 5/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
PLAU P00749 1/20 0.45
C1S P09871 1/20 0.45
KDM4A O75164 1/20 0.44
KDM4B O94953 1/20 0.44
KDM5C P41229 1/20 0.44
KDM5B Q9UGL1 1/20 0.44
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL7220726 0.86 KDM4E (0.59) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL7221315 0.85 L3MBTL1 (0.52) MEN1KMT2AMAPT
SCHEMBL12171860 0.81 CYP17A1 (0.60) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL17336823 0.81 KDM4E (0.64) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL1505287 0.80 SREBF2 (0.65) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL7221006 0.80 EIF4E (0.48) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL7220991 0.79 SMN1; SMN2 (0.59) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL7222081 0.79 KDM4E (0.57) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL19196251 0.78 SMN1; SMN2 (0.65) EIF4ESMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL12171834 0.78 NPC1 (0.75) EIF4ESMN1; SMN2KDM4ERAB9ANPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1314899-A Retinoid-associated receptor regulators TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-09-26 CN claimed
EP-1092711-A1 RETINOID-ASSOCIATED RECEPTOR REGULATORS Takeda Chemical Industries, Ltd. (JP) 2001-04-18 EP claimed
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
CN-1314899-A Retinoid-associated receptor regulators TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-09-26 CN disclosed
EP-1092711-A1 RETINOID-ASSOCIATED RECEPTOR REGULATORS Takeda Chemical Industries, Ltd. (JP) 2001-04-18 EP disclosed