SCHEMBL16622121

SCHEMBL16622121

CC(=O)OCOC(=O)/C=C\C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 12/20 0.59
TSHR P16473 3/20 0.39
TP53 P04637 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
HSD17B10 Q99714 3/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 2/20 0.36
RECQL P46063 2/20 0.36

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
SCHEMBL10991550 1.00 HCAR2 (0.59) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL10991546 1.00 HCAR2 (0.59) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL10991544 0.91 HCAR2 (0.44) HCAR2TSHRALDH1A1MAPTATM
SCHEMBL17487299 0.91 HCAR2 (0.44) HCAR2TSHRALDH1A1MAPTATM
SCHEMBL13524059 0.89 HCAR2 (0.65) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL5873269 0.89 HCAR2 (0.65) HCAR2TSHRTP53EGLN1EGLN3
Butane SCHEMBL9548193 0.84 HCAR2 (0.69) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL28908590 0.83 HCAR2 (0.67) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL10394955 0.80 HCAR2 (0.61) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL10394953 0.80 HCAR2 (0.61) HCAR2TSHRTP53EGLN1EGLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8998400-B2 Copolymer, aqueous ink, and ink cartridge RICOH COMPANY, LTD. (JP) 2015-04-07 US disclosed