SCHEMBL8288670

SCHEMBL8288670

NC(=O)c1c(NC(=O)Cc2ccc(F)cc2)sc2c1CCCC2

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.80
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
NPC1 O15118 2/20 0.67
RAB9A P51151 2/20 0.67
ALDH1A1 P00352 4/20 0.67
MAPT P10636 3/20 0.67
GAA P10253 2/20 0.67
RXFP1 Q9HBX9 1/20 0.64
LMNA P02545 3/20 0.64
MAPK10 P53779 1/20 0.64
HSD17B10 Q99714 1/20 0.64
TSHR P16473 2/20 0.61
GFER P55789 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
KDM4E B2RXH2 1/20 0.60
MAPK1 P28482 1/20 0.60
TP53 P04637 1/20 0.59
THRB P10828 1/20 0.59
HPGD P15428 2/20 0.59

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
SCHEMBL8288812 0.99 FLT3 (0.79) FLT3MEN1KMT2ANPC1RAB9A
SCHEMBL5453222 0.89 FLT3 (1.00) FLT3MEN1KMT2ANPC1RAB9A
SCHEMBL8290936 0.89 FLT3 (0.82) FLT3MEN1KMT2AALDH1A1MAPT
SCHEMBL5460296 0.85 FLT3 (0.80) FLT3MEN1KMT2AMAPTRXFP1
SCHEMBL3914715 0.84 FLT3 (0.74) FLT3MEN1KMT2ANPC1ALDH1A1
SCHEMBL8289526 0.83 RAB9A (0.95) FLT3MEN1KMT2ANPC1RAB9A
SCHEMBL5455065 0.82 MEN1 (0.79) FLT3MEN1KMT2ANPC1RAB9A
SCHEMBL8289432 0.81 KMT2A (1.00) FLT3MEN1KMT2AALDH1A1RXFP1
SCHEMBL8290774 0.80 KMT2A (0.98) FLT3MEN1KMT2AALDH1A1MAPT
SCHEMBL8289500 0.79 RXFP1 (1.00) FLT3MEN1KMT2ARAB9AMAPT

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
WO-2005033102-A2 THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-04-14 WO disclosed