SCHEMBL8997286

SCHEMBL8997286

O=C(O)C(O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
MAPK1 P28482 1/20 0.58
HIF1A Q16665 1/20 0.55
SRC P12931 1/20 0.52
ESR1 P03372 2/20 0.48
ESR2 Q92731 1/20 0.48
CYP3A4 P08684 2/20 0.47
CYP17A1 P05093 1/20 0.47
CYP19A1 P11511 1/20 0.47
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
MMP3 P08254 1/20 0.46
BCL2L1 Q07817 1/20 0.46
APP P05067 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 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
SCHEMBL1957930 0.93 LMNA (0.65) LMNAMAPK1HIF1ASRCESR1
SCHEMBL352555 0.93 LMNA (0.65) LMNAMAPK1HIF1ASRCESR1
SCHEMBL467741 0.93 LMNA (0.65) LMNAMAPK1HIF1ASRCESR1
SCHEMBL31484031 0.93 LMNA (0.65) LMNAMAPK1HIF1ASRCESR1
SCHEMBL7522519 0.91 LMNA (0.62) LMNAMAPK1HIF1ASRCESR1
Water SCHEMBL564812 0.91 LMNA (0.62) LMNAMAPK1HIF1ASRCESR1
SCHEMBL10954019 0.91 LMNA (0.62) LMNAMAPK1HIF1ASRCESR1
SCHEMBL10957256 0.91 LMNA (0.62) LMNAMAPK1HIF1ASRCESR1
SCHEMBL5088395 0.91 LMNA (0.62) LMNAMAPK1HIF1ASRCESR1
Ammonia Solution, Strong SCHEMBL7530577 0.91 LMNA (0.62) LMNAMAPK1HIF1ASRCESR1

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-0459455-B1 Process for producing optically active alpha-hydroxyesters CHISSO CORP (JP) 1996-09-04 EP disclosed
US-5248610-A Transesterification CHISSO CORPORATION (JP) 1993-09-28 US disclosed
EP-0459455-A2 Process for producing optically active alpha-hydroxyesters CHISSO CORPORATION (JP) 1991-12-04 EP disclosed
US-3941821-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETICS WILLIAM H. RORER, INC. (US) 1976-03-02 US disclosed