SCHEMBL19982707

SCHEMBL19982707

CCNC(=O)c1cc(C(C)=O)cc(C(=O)NCC)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
CA5A P35218 1/20 0.43
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
BRD4 O60885 3/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
MEN1 O00255 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
HPGDS O60760 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EPHX2 P34913 1/20 0.39
NR1H4 Q96RI1 1/20 0.39

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
SCHEMBL16317402 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA5AMAPTRAB9AL3MBTL1
SCHEMBL9979308 0.91 SMN1; SMN2 (0.48) SMN1; SMN2MAPTRAB9AL3MBTL1BRD4
SCHEMBL13753330 0.84 SMN1; SMN2 (0.59) SMN1; SMN2L3MBTL1KMT2AGAAHSD17B10
SCHEMBL12347956 0.83 EPHX2 (0.54) MAPTRAB9AL3MBTL1KMT2ACA12
SCHEMBL13714731 0.83 BRD4 (0.44) SMN1; SMN2MAPTRAB9AL3MBTL1BRD4
SCHEMBL15835231 0.81 L3MBTL1 (0.56) SMN1; SMN2MAPTRAB9AL3MBTL1PTGS1
SCHEMBL25837115 0.79 RAB9A (0.50) SMN1; SMN2CA5AMAPTRAB9AL3MBTL1
SCHEMBL1003870 0.78 GAA (0.54) SMN1; SMN2MAPTRAB9AL3MBTL1BRD4
SCHEMBL13435320 0.78 MEN1 (0.47) SMN1; SMN2MAPTRAB9AL3MBTL1BRD4
SCHEMBL9713054 0.78 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1KMT2AGAAHSD17B10

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-20180079868-A1 QUANTUM DOT-CONTAINING COMPOSITION, WAVELENGTH CONVERSION MEMBER, BACKLIGHT UNIT, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2018-03-22 US disclosed