SCHEMBL2416294

SCHEMBL2416294

CCOCCOOOC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.45
THRB P10828 1/20 0.39
NPC1 O15118 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 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
SCHEMBL491693 0.84 ALDH1A1 (0.46) ALDH1A1TSHRTHRBNPC1HPGD
SCHEMBL5670469 0.84 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL5670466 0.81 ALDH1A1 (0.43) ALDH1A1TSHRTHRB
SCHEMBL5300874 0.79
SCHEMBL4760584 0.79
Bicarbonate SCHEMBL6272395 0.79 ALDH1A1 (0.54) ALDH1A1TSHRTHRBNPC1HPGD
SCHEMBL3877437 0.76 ALDH1A1 (0.43) ALDH1A1TSHRHPGD
Bicarbonate SCHEMBL376795 0.75 ALDH1A1 (0.62) ALDH1A1TSHRTHRBNPC1HPGD
Bicarbonate SCHEMBL11500913 0.75 ALDH1A1 (0.62) ALDH1A1TSHRTHRBNPC1HPGD
SCHEMBL5764632 0.75 ALDH1A1 (0.45) ALDH1A1TSHRTHRB

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-2547528-A1 LIQUID DROPLET EJECTING METHOD, LIQUID DROPLET EJECTION APPARATUS, INKJET RECORDING APPARATUS, PRODUCTION METHOD OF FINE PARTICLES, FINE PARTICLE PRODUCTION APPARATUS, AND TONER Ricoh Company, Ltd. (JP) 2013-01-23 EP disclosed
WO-2011115303-A1 LIQUID DROPLET EJECTING METHOD, LIQUID DROPLET EJECTION APPARATUS, INKJET RECORDING APPARATUS, PRODUCTION METHOD OF FINE PARTICLES, FINE PARTICLE PRODUCTION APPARATUS, AND TONER RICOH COMPANY, LTD. (JP) 2011-09-22 WO disclosed