SCHEMBL9430816

SCHEMBL9430816

CC(=O)c1ccc(-c2ncco2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.56
HDAC4 P56524 1/20 0.41
IL2 P60568 1/20 0.41
TRPM4 Q8TD43 1/20 0.41
GLRA3 O75311 1/20 0.39
GLRB P48167 1/20 0.39
LTA4H P09960 3/20 0.39
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
RXRB P28702 2/20 0.37
HPGDS O60760 1/20 0.36
RXRA P19793 1/20 0.36
KIF18A Q8NI77 1/20 0.36
P2RX7 Q99572 1/20 0.36
EDNRB P24530 2/20 0.36
EDNRA P25101 2/20 0.36
RARA P10276 1/20 0.36
RARB P10826 1/20 0.36
RARG P13631 1/20 0.36
LCK P06239 1/20 0.35

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
SCHEMBL3375921 0.89 BRD4 (0.48) BRD4HDAC4IL2TRPM4GLRA3
SCHEMBL6514687 0.79 BRD4 (0.49) BRD4HDAC4GLRA3GLRBLTA4H
SCHEMBL18930006 0.79 NPC1 (0.46) BRD4IL2LTA4HHPGDSP2RX7
SCHEMBL10320333 0.78 BRD4 (0.46) BRD4HDAC4IL2TRPM4GLRA3
SCHEMBL14339149 0.76 RARA (0.38) MKNK1MKNK2RXRBRXRAKIF18A
SCHEMBL24746118 0.74 LTA4H (0.42) BRD4HDAC4IL2GLRA3GLRB
SCHEMBL8281253 0.74 GRIN2B (0.46) BRD4IL2LTA4HHPGDSP2RX7
SCHEMBL1829295 0.74 ALDH1A1 (0.53) BRD4HDAC4IL2LTA4HHPGDS
SCHEMBL1459806 0.74 S1PR1 (0.44) BRD4HDAC4IL2GLRA3GLRB
SCHEMBL12590188 0.74 BRD4 (0.40) BRD4HDAC4IL2GLRA3GLRB

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-5296607-A Light sensitive compounds for optical recording media or copies YAMAHA CORPORATION (JP) 1994-03-22 US disclosed