SCHEMBL7805867

SCHEMBL7805867

COCOc1ccc2c(c1)OCC(C)(c1ccc(C(=O)O)cc1)C2CCCCCCCCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.33
PPARD Q03181 7/20 0.33
FFAR1 O14842 4/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
GPR119 Q8TDV5 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
PLA2G4B P0C869 1/20 0.31
RXRA P19793 1/20 0.31
HNF4A P41235 1/20 0.31
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTPN1 P18031 1/20 0.30
PTPN11 Q06124 1/20 0.30

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
SCHEMBL5857148 0.93 EGFR (0.33) PPARGPPARDFFAR1GPR119MEN1
SCHEMBL5853765 0.92 PTPN1 (0.32) PPARGPPARDFFAR1PTPN1
SCHEMBL5854950 0.91 PTPN1 (0.32) PPARGPPARDFFAR1PTPN1
SCHEMBL5857347 0.90 PTPN1 (0.35) PPARGPPARDFFAR1PTPN1
SCHEMBL5854575 0.89 PTPN1 (0.33) PPARGPPARDFFAR1PTPN1
SCHEMBL5854864 0.88
SCHEMBL5855529 0.83 RAB9A (0.34) PPARGPPARDFFAR1
SCHEMBL5856095 0.83 MAOB (0.33) PPARGPPARDFFAR1PTPN1
SCHEMBL6791071 0.82 HTR1A (0.32)
SCHEMBL7812199 0.81 PPARD (0.39) PPARGPPARDFFAR1TSHRPTPN1

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
EP-1087959-A1 NOVEL BENZOPYRAN OR THIOBENZOPYRAN DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-04-04 EP disclosed
WO-1999065893-A1 NOVEL BENZOPYRAN OR THIOBENZOPYRAN DERIVATIVES C & C RESEARCH LABORATORIES (KR) 1999-12-23 WO disclosed