SCHEMBL991607

SCHEMBL991607

CC=COCCOC(=O)/C=C/C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 12/20 0.58
ATM Q13315 1/20 0.42
TSHR P16473 4/20 0.33
TP53 P04637 3/20 0.33
MAPT P10636 2/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
EGLN3 Q9H6Z9 1/20 0.33
AKR1B10 O60218 1/20 0.33
AKR1B1 P15121 1/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 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
SCHEMBL991610 1.00 HCAR2 (0.58) HCAR2ATMTSHRTP53MAPT
SCHEMBL991606 0.92 ATM (0.48) HCAR2ATMTSHRTP53MAPT
SCHEMBL5973818 0.92 ATM (0.48) HCAR2ATMTSHRTP53MAPT
SCHEMBL991608 0.92 ATM (0.48) HCAR2ATMTSHRTP53MAPT
SCHEMBL5973821 0.92 ATM (0.48) HCAR2ATMTSHRTP53MAPT
SCHEMBL5973231 0.92 ATM (0.48) HCAR2ATMTSHRTP53MAPT
SCHEMBL11045900 0.82 HCAR2 (0.74) HCAR2ATMTSHRTP53MAPT
SCHEMBL1246524 0.82 HCAR2 (0.74) HCAR2ATMTSHRTP53MAPT
SCHEMBL10780616 0.82 HCAR2 (0.74) HCAR2ATMTSHRTP53MAPT
SCHEMBL1815816 0.79 HCAR2 (0.59) HCAR2ATMTSHRTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8475938-B2 Organic electroluminescent element, lighting device and display device KONICA MINOLTA HOLDINGS, INC. (JP) 2013-07-02 US disclosed
US-20110017988-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, LIGHTING DEVICE AND DISPLAY DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2011-01-27 US disclosed
EP-1301461-A2 FUMARATE DERIVATIVE, METHOD FOR PRODUCING THE SAME Showa Denko K.K. (JP) 2003-04-16 EP disclosed
WO-2002006206-A2 FUMARATE DERIVATIVE, METHOD FOR PRODUCING THE SAME SHOWA DENKO K.K. (JP) 2002-01-24 WO disclosed
EP-0957079-A1 NEW ETHER COMPOUNDS AND PROCESS FOR PRODUCING THE SAME Showa Denko Kabushiki Kaisha (JP) 1999-11-17 EP disclosed