SCHEMBL7585298

SCHEMBL7585298

COCOc1ccc(C2COc3cc(OCOC)ccc3C2(O)c2cccc(OCCCCCCl)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.36
PPARD Q03181 12/20 0.36
FFAR1 O14842 9/20 0.34
PPARA Q07869 1/20 0.33
PTPN1 P18031 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
NPY1R P25929 1/20 0.30
MAOB P27338 2/20 0.30
MAOA P21397 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL7587802 0.93 PPARG (0.33) PPARGPPARDFFAR1PPARAPTPN1
SCHEMBL7589438 0.85 PTPN1 (0.37) PPARGPPARDPTPN1KDM4EMEN1
SCHEMBL7589364 0.85 PPARG (0.33) PPARGPPARDFFAR1PPARAPTPN1
SCHEMBL5854628 0.84 PPARG (0.32) PPARGPPARDFFAR1PTPN1MAOB
SCHEMBL5856395 0.80 PTPN1 (0.37) PTPN1
SCHEMBL2570756 0.79 MEN1 (0.47) KDM4EMEN1MAPTKMT2A
SCHEMBL5856143 0.79 PPARG (0.32) PPARGPPARDFFAR1PTPN1MAOB
SCHEMBL8521150 0.78 PTPN1 (0.34) PTPN1
SCHEMBL7589620 0.78 ESR1 (0.31)
SCHEMBL7588458 0.77 ESR1 (0.43) MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944613-B1 BENZOPYRAN DERIVATIVES CHUGAI PHARMACEUTICAL CO LTD (JP) 2002-10-09 EP disclosed
US-6153768-A RECEPTOR BLOCKING ANTIESTROGENS HAVING REDUCED SIDE EFFECTS C & C RESEARCH LABORATORIES (KR) 2000-11-28 US disclosed
EP-0944613-A1 NOVEL BENZOPYRAN DERIVATIVES C & C Research Laboratories (KR) 1999-09-29 EP disclosed
WO-1998025916-A1 NOVEL BENZOPYRAN DERIVATIVES C & C RESEARCH LABORATORIES (KR) 1998-06-18 WO disclosed