SCHEMBL25880393

SCHEMBL25880393

C=C1c2ccccc2C(=O)N1c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SCN2A Q99250 3/20 0.52
CA12 O43570 2/20 0.52
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
CA9 Q16790 2/20 0.52
ALDH1A1 P00352 6/20 0.50
GAA P10253 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
PKM P14618 1/20 0.50
TLR9 Q9NR96 1/20 0.50
HSPA1A P0DMV8 1/20 0.50
PABPC1 P11940 1/20 0.50
ESR1 P03372 1/20 0.50
CES2 O00748 1/20 0.50
BCHE P06276 1/20 0.50
CES1 P23141 1/20 0.50
PGR P06401 1/20 0.47
NR1H3 Q13133 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
SCHEMBL12464406 0.94 KMT2A (0.59) MEN1KMT2ASCN2ACA12CA1
SCHEMBL12464603 0.92 KMT2A (0.62) MEN1KMT2ASCN2ACA12CA1
SCHEMBL29842449 0.86 ALDH1A1 (0.64) MEN1KMT2ASCN2ACA12CA1
SCHEMBL28812426 0.86 ALDH1A1 (0.64) MEN1KMT2ASCN2ACA12CA1
SCHEMBL6589327 0.85 ALDH1A1 (0.56) MEN1KMT2ASCN2ACA12CA1
N-Phenyl-Phthalimide SCHEMBL29819622 0.84 KMT2A (0.68) MEN1KMT2ASCN2ACA12CA1
SCHEMBL19773976 0.84 KMT2A (0.68) MEN1KMT2ASCN2ACA12CA1
N-Phenyl-Phthalimide SCHEMBL123618 0.84 KMT2A (0.68) MEN1KMT2ASCN2ACA12CA1
N-Phenyl-Phthalimide SCHEMBL27271803 0.82 KMT2A (0.65) MEN1KMT2ASCN2ACA12CA1
SCHEMBL24453235 0.81 KMT2A (0.44) MEN1KMT2ASCN2ACA12CA1

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-20230235116-A1 HIGH-TEMPERATURE SELF-CROSSLINKING-BASED FLAME-RETARDANT ANTI-DRIPPING COPOLYESTER, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SICHUAN UNIVERSITY (CN) 2023-07-27 US disclosed