SCHEMBL175164

SCHEMBL175164

Fc1ccc(C(F)(F)c2nc(Nc3cc[nH]n3)c3ccsc3n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RAB9A P51151 1/20 0.31
LCK P06239 1/20 0.30
ITK Q08881 1/20 0.30
AURKB Q96GD4 1/20 0.30
GGPS1 O95749 1/20 0.30
MALT1 Q9UDY8 1/20 0.30

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
SCHEMBL175046 0.83 PAK4 (0.33) RAB9ALCKAURKB
SCHEMBL174795 0.82 FLT3 (0.36) MEN1KMT2ARAB9ALCKITK
SCHEMBL168897 0.82 NTRK1 (0.45) AURKB
SCHEMBL174445 0.80 CCNE2 (0.44) MEN1KMT2A
SCHEMBL174490 0.80 AURKB (0.41) MEN1KMT2ALCKITKAURKB
SCHEMBL174171 0.76 NTRK1 (0.41) MEN1KMT2AAURKB
SCHEMBL13011344 0.76 CTNNB1 (0.38) MEN1KMT2ALCKITKAURKB
SCHEMBL174887 0.75 ADORA3 (0.36) LCKAURKB
SCHEMBL173271 0.74 AURKB (0.44) MEN1KMT2ALCKITKAURKB
SCHEMBL166410 0.73 HTR2C (0.38) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611812-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2013-07-10 EP claimed
WO-2012030894-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 WO claimed
EP-2611812-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2013-07-10 EP disclosed
WO-2012030894-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 WO disclosed
WO-2012030894-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 WO disclosed