SCHEMBL28025587

SCHEMBL28025587

NC(=O)c1ccc(C(F)(F)F)cc1-c1nc(-c2ccccc2)cs1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.55
KDM4E B2RXH2 4/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.54
C1S P09871 1/20 0.53
EIF4E P06730 8/20 0.52
USP2 O75604 2/20 0.47
USP8 P40818 2/20 0.47
MAPT P10636 2/20 0.46
MAPK1 P28482 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PLAU P00749 1/20 0.45

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
SCHEMBL5968562 0.81 RAB9A (0.62) GFERKDM4EMEN1KMT2AALDH1A1
SCHEMBL6018315 0.80 BCAT2 (0.56) KDM4EALDH1A1
SCHEMBL28355353 0.75 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1EIF4E
SCHEMBL21462074 0.75 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1EIF4E
SCHEMBL28662231 0.75 BCAT2 (0.56) KDM4EALDH1A1
SCHEMBL27965806 0.74 RAB9A (0.78) GFERKDM4EMEN1KMT2AALDH1A1
SCHEMBL21479755 0.74 SMN1; SMN2 (0.65) GFERKDM4EMEN1KMT2AALDH1A1
SCHEMBL30279818 0.74 SMN1; SMN2 (0.65) GFERKDM4EMEN1KMT2AALDH1A1
SCHEMBL22617059 0.73 USP2 (0.66) KDM4EMEN1KMT2AUSP2USP8
SCHEMBL7221341 0.72 KDM4E (0.74) GFERKDM4EMEN1KMT2AALDH1A1

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-103232406-B A kind of 1,3-thiazoles derivative PEKING UNIVERSITY (CN) 2015-07-29 CN disclosed