SCHEMBL28059002

SCHEMBL28059002

Cc1nc(N)sc1-c1ccnc(NC(=O)c2ccc(F)cc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 10/20 0.52
LOXL2 Q9Y4K0 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MAPK14 Q16539 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
USP2 O75604 1/20 0.42
ATM Q13315 1/20 0.42
HTR1F P30939 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
ABL1 P00519 1/20 0.40

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
SCHEMBL28059033 0.80 SORT1 (0.44) PIK3C3MEN1KMT2ANPC1RAB9A
SCHEMBL28059092 0.77 MAPK14 (0.52) MEN1KMT2AMAPK14L3MBTL1TDP1
SCHEMBL28059011 0.75 ABCB1 (0.47) MEN1KMT2AMAPK14L3MBTL1USP2
SCHEMBL28059025 0.74 MEN1 (0.41) PIK3C3MEN1KMT2ANPC1RAB9A
SCHEMBL3075444 0.73 GPR52 (0.47) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL28059020 0.73 AURKA (0.55) MEN1KMT2ANPC1RAB9AMAPK14
SCHEMBL17001118 0.72 PIK3C3 (0.74) PIK3C3
SCHEMBL28059001 0.72 MAPK10 (0.61) MEN1KMT2ANPC1RAB9AUSP2
SCHEMBL28059009 0.71 MEN1 (0.46) MEN1KMT2ANPC1RAB9AL3MBTL1
SCHEMBL28059097 0.70 CDK4 (0.46) MEN1KMT2ANPC1RAB9AL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105585565-A 2-phenylamino-4-thiazolyl pyridine derivatives, preparing method thereof, pharmaceutical compositions of the derivatives and uses of the derivatives INST MATERIA MEDICA CAMS 2016-05-18 CN claimed
CN-105585565-A 2-phenylamino-4-thiazolyl pyridine derivatives, preparing method thereof, pharmaceutical compositions of the derivatives and uses of the derivatives INST MATERIA MEDICA CAMS 2016-05-18 CN disclosed