SCHEMBL5808045

SCHEMBL5808045

CO[C@H]1O[C@H](C(O)C(=O)c2ccccc2)[C@H](O)[C@@](O)(C(=O)c2ccccc2)[C@]1(O)C(=O)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.34
EPAS1 Q99814 1/20 0.34
CES2 O00748 2/20 0.32
CES1 P23141 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP3A4 P08684 1/20 0.31
ROCK2 O75116 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
ATM Q13315 1/20 0.30
NPY5R Q15761 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
SCHEMBL1682170 0.88 HIF1A (0.33) HIF1AEPAS1CES2CES1LMNA
SCHEMBL7638594 0.85 HIF1A (0.37) HIF1AEPAS1CES2CES1LMNA
SCHEMBL9751520 0.83 POLB (0.30) MAPTNPC1RAB9APOLBMEN1
SCHEMBL9094342 0.83 MDM2 (0.35) LMNAMEN1KMT2AALDH1A1CYP3A4
SCHEMBL8583697 0.78 HIF1A (0.32) HIF1AEPAS1CES2CES1LMNA
SCHEMBL8818025 0.76 TSHR (0.37) HIF1AEPAS1CES2CES1LMNA
SCHEMBL4629214 0.74 HIF1A (0.32) HIF1AEPAS1
SCHEMBL3984769 0.73 ALDH1A1 (0.36) HIF1AEPAS1CES2CES1LMNA
SCHEMBL8982590 0.73 ALDH1A1 (0.36) HIF1AEPAS1CES2CES1LMNA
SCHEMBL27513098 0.73 ALDH1A1 (0.36) HIF1AEPAS1CES2CES1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3094639-A1 METHOD FOR OPTIMIZING POST-TRANSLATIONAL MODIFICATIONS ON RECOMBINANT PROTEINS Leszcyniecka, Magdalena (US) 2016-11-23 EP disclosed
WO-2015106276-A1 METHOD FOR OPTIMIZING POST-TRANSLATIONAL MODIFICATIONS ON RECOMBINANT PROTEINS LESZCYNIECKA MAGDALENA (US) 2015-07-16 WO disclosed
WO-2006127842-A2 TRACERS FOR MONITORING THE ACTIVITY OF SODIUM/GLUCOSE COTRANSPORTERS IN HEALTH AND DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-11-30 WO disclosed
US-6468688-B2 CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE PINNACLE VRB LIMITED (AU) 2002-10-22 US disclosed
US-20010028977-A1 Charging, discharging efficiency; vanadium electrolyte JD HOLDING INC. (KY) 2001-10-11 US disclosed
EP-0428605-A1 SYNTHETIC RECEPTOR ANALOGUES. SYMBICOM AB (SE) 1991-05-29 EP disclosed
WO-1990001488-A1 SYNTHETIC RECEPTOR ANALOGUES SYMBICOM AKTIEBOLAG (SE) 1990-02-22 WO disclosed