SCHEMBL5237113

SCHEMBL5237113

CC(=O)Cc1ccc(F)c2c(F)cccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MPO P05164 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
NOD2 Q9HC29 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CXCL8 P10145 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
ERN1 O75460 1/20 0.34
RIPK1 Q13546 1/20 0.33

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
SCHEMBL5235068 0.83 IAPP (0.46) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL5240138 0.82 KMT2A (0.46) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL5239308 0.82 FFAR1 (0.41) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL5234763 0.76 NOTUM (0.39) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL23365341 0.76 TDP1 (0.36) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL11205828 0.74 RIPK1 (0.46) KMT2AMEN1CES2CES1L3MBTL1
SCHEMBL6046939 0.74 KMT2A (0.57) KMT2AMEN1MAPTPOLBTDP1
SCHEMBL125583 0.74 ALDH1A1 (0.49) LMNARAB9ANPC1NOD2L3MBTL1
SCHEMBL9102212 0.73 P2RX7 (0.45) KMT2AMEN1RAB9ANPC1CES2
SCHEMBL28357376 0.73 ANO1 (0.47) KMT2AMEN1CES2CES1L3MBTL1

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
EP-1851232-A2 DIHYDROIMIDAZOTHIAZOLE DERIVATIVES Prosidion Limited (GB) 2007-11-07 EP disclosed
WO-2006085118-A2 DIHYDROIMIDAZOTHIAZOLE DERIVATIVES PROSIDION LIMITED (GB) 2006-08-17 WO disclosed