SCHEMBL10174240

SCHEMBL10174240

CCC(C)C(=O)OCCOC(=O)/C=C\C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 13/20 0.61
ATM Q13315 1/20 0.46
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL2113004 0.83 HCAR2 (0.62) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL2113000 0.83 HCAR2 (0.62) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL13667079 0.80 ALDH1A1 (0.37) ALDH1A1GAA
SCHEMBL1246524 0.80 HCAR2 (0.74) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL11045900 0.80 HCAR2 (0.74) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL10780616 0.80 HCAR2 (0.74) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL11744203 0.79 HCAR2 (0.61) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL10033520 0.78 TSHR (0.55) HCAR2ATMALDH1A1
Propyl Fumarate SCHEMBL322229 0.77 HCAR2 (1.00) HCAR2ATMMAPTRAB9ANPSR1
Propyl Fumarate SCHEMBL322230 0.77 HCAR2 (1.00) HCAR2ATMMAPTRAB9ANPSR1

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
US-8124317-B2 Planographic printing plate precursor and method of producing a copolymer used therein FUJIFILM CORPORATION (JP) 2012-02-28 US disclosed
US-20090087787-A1 PLANOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF PRODUCING A COPOLYMER USED THEREIN FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed