SCHEMBL8545190

SCHEMBL8545190

CC(=CC(C)NO)c1cccc(OCc2nc(-c3ccc(C(F)(F)F)cc3)oc2C)c1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.54
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
CYP2C9 P11712 1/20 0.49
KCNH2 Q12809 1/20 0.49
KDR P35968 1/20 0.47
MAPT P10636 2/20 0.46
TP53 P04637 2/20 0.45

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
SCHEMBL8545188 1.00 PTPN1 (0.54) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8545185 1.00 PTPN1 (0.54) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8546044 0.90 PTPN1 (0.56) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8546050 0.90 PTPN1 (0.56) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8546040 0.90 PTPN1 (0.56) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8546314 0.87 PTPN1 (0.58) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8546303 0.87 PTPN1 (0.58) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8546309 0.87 PTPN1 (0.58) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8549456 0.86 KDR (0.51) PTPN1PPARGPPARACYP2C9KCNH2
SCHEMBL8549447 0.86 KDR (0.51) PTPN1PPARGPPARACYP2C9KCNH2

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
EP-0759919-B1 AZOLIDINEDIONES AS ANTIHYPERGLYCEMIC AGENTS AMERICAN HOME PROD (US) 1998-11-11 EP disclosed
US-5532256-A ORALLY ADMINISTERED ANTIDIABETIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-07-02 US disclosed
US-5468762-A Antidiabetic agents for administering by mouth AMERICAN HOME PRODUCTS CORPORATION (US) 1995-11-21 US disclosed