SCHEMBL8128997

SCHEMBL8128997

Cc1oc(-c2ccccc2)nc1COc1ccc2cc(C=C3SC(=O)NC3=O)oc2c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.47
PPARA Q07869 5/20 0.47
KDR P35968 1/20 0.46
HPGD P15428 4/20 0.46
FFAR1 O14842 1/20 0.45
PTPN1 P18031 4/20 0.44
KCNH2 Q12809 1/20 0.44
POLB P06746 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
HDAC4 P56524 2/20 0.42
PIK3CG P48736 1/20 0.42
HDAC8 Q9BY41 1/20 0.42

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
SCHEMBL8128996 1.00 PPARG (0.47) PPARGPPARAKDRHPGDFFAR1
SCHEMBL10365494 0.86 HPGD (0.61) PPARGPPARAHPGDFFAR1PTPN1
SCHEMBL10365493 0.86 HPGD (0.61) PPARGPPARAHPGDFFAR1PTPN1
SCHEMBL6972649 0.83 KDR (0.48) PPARGPPARAKDRHPGDFFAR1
SCHEMBL8122331 0.82 KDR (0.56) PPARGPPARAKDRFFAR1PTPN1
SCHEMBL6973022 0.81 PPARG (0.47) PPARGPPARAKDRHPGDFFAR1
SCHEMBL8337047 0.81 PPARG (0.47) PPARGPPARAKDRHPGDFFAR1
SCHEMBL8139624 0.79 KDR (0.53) PPARGPPARAKDRFFAR1PTPN1
SCHEMBL8139628 0.79 KDR (0.53) PPARGPPARAKDRFFAR1PTPN1
SCHEMBL8141923 0.79 KCNH2 (0.50) PPARGPPARAHPGDPTPN1KCNH2

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
EP-0733631-B1 Benzofuran derivates useful as hypoglycemic and hypolidemic agents TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-07-12 EP claimed
EP-0733631-A1 Benzofuran derivates useful as hypoglycemic and hypolidemic agents Takeda Chemical Industries, Ltd. (JP) 1996-09-25 EP claimed
EP-0733631-B1 Benzofuran derivates useful as hypoglycemic and hypolidemic agents TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-07-12 EP disclosed
US-5723479-A ANTILIPEMIC AGENTS AND ANTIGLYCEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-03 US disclosed
EP-0733631-A1 Benzofuran derivates useful as hypoglycemic and hypolidemic agents Takeda Chemical Industries, Ltd. (JP) 1996-09-25 EP disclosed