SCHEMBL4587327

SCHEMBL4587327

C=C(CC=CC(=O)O)C(=O)OCCCO

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.35
TSHR P16473 3/20 0.32
GABRR1 P24046 2/20 0.31
GABRR2 P28476 2/20 0.31
BLM P54132 2/20 0.31
GABRR3 A8MPY1 1/20 0.31
LMNA P02545 1/20 0.31
APEX1 P27695 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL916717 0.90 TSHR (0.38) HCAR2TSHRGABRR1GABRR2BLM
Acrylic Acid SCHEMBL7214438 0.85 TSHR (0.43) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL313840 0.85 HCAR2 (0.53) HCAR2TSHRNPSR1TDP1
SCHEMBL325215 0.84 HCAR2 (0.54) HCAR2TSHRLMNANPSR1
SCHEMBL11043890 0.83 GABRR1 (0.33) HCAR2TSHRGABRR1GABRR2BLM
SCHEMBL121143 0.83 HCAR2 (0.55) HCAR2TSHRLMNANPSR1
SCHEMBL6060612 0.83 HCAR2 (0.55) HCAR2TSHRLMNANPSR1
SCHEMBL9299634 0.83 HCAR2 (0.55) HCAR2TSHRLMNANPSR1
SCHEMBL10347496 0.83 HCAR2 (0.55) HCAR2TSHRLMNANPSR1
SCHEMBL7115770 0.82 GABRR1 (0.35) HCAR2TSHRGABRR1GABRR2BLM

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-1766386-B1 Product shelf life monitoring systems and ultraviolet radiation-absorbent ink. TEMPTIME CORP (US) 2013-05-15 EP disclosed
EP-1766386-A4 PRODUCT SHELF LIFE MONITORING SYSTEMS TEMPTIME CORP (US) 2008-07-23 EP disclosed
EP-1766386-A1 PRODUCT SHELF LIFE MONITORING SYSTEMS TEMPTIME CORPORATION (US) 2007-03-28 EP disclosed
WO-2006001801-A1 PRODUCT SHELF LIFE MONITORING SYSTEMS TEMPTIME CORPORATION (US) 2006-01-05 WO disclosed