SCHEMBL28115354

SCHEMBL28115354

O=C1C=CC(=O)N1c1ccc(O)cc1.O=[C]O

nearest known ligand 0.87

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 14/20 0.87
HSP90AA1 P07900 3/20 0.87
TDP1 Q9NUW8 2/20 0.87
PKM P14618 1/20 0.87
MAPK1 P28482 1/20 0.87
NPSR1 Q6W5P4 1/20 0.87
FAAH O00519 5/20 0.65
DDAH1 O94760 1/20 0.53
APAF1 O14727 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
BCHE P06276 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
CCR6 P51684 1/20 0.47
CACNA1B Q00975 1/20 0.47
APBA1 Q02410 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47

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
SCHEMBL140288 0.93 MGLL (1.00) MGLLHSP90AA1TDP1PKMMAPK1
Ethane SCHEMBL27957486 0.89 MGLL (0.91) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL28721282 0.87 MGLL (0.87) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL24204848 0.87 MGLL (0.87) MGLLHSP90AA1TDP1PKMMAPK1
Phenol SCHEMBL6695797 0.85 MGLL (0.83) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL15902727 0.82 MGLL (0.77) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL22862097 0.82 MGLL (0.77) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL22862146 0.82 MGLL (0.77) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL28494489 0.82 MGLL (0.81) MGLLHSP90AA1TDP1PKMMAPK1
SCHEMBL28552782 0.82 MGLL (0.77) MGLLHSP90AA1TDP1PKMMAPK1

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
CN-106336739-A Pigment dispersion for color filter, coloring composition for color filter, color filter and display device DNP精细化工股份有限公司 2017-01-18 CN disclosed