SCHEMBL409129

SCHEMBL409129

CCS(=O)(=O)[O-].Cn1cc[n+](C)c1

nearest known ligand 0.41

Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4FLT1FLT4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEN1 O00255 1/20 0.38
APAF1 O14727 1/20 0.38
NPC1 O15118 1/20 0.38
PLA2G1B P04054 1/20 0.38
HSP90AA1 P07900 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
ATM Q13315 1/20 0.33
FDPS P14324 2/20 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
SCHEMBL29074312 0.90 MAPT (0.37) MAPTNPSR1MEN1APAF1NPC1
Sulfuric Acid SCHEMBL4539581 0.90 MAPT (0.36) MAPTNPSR1MEN1APAF1NPC1
Sulfuric Acid SCHEMBL15227677 0.88 MAPT (0.38) MAPTNPSR1MEN1APAF1NPC1
SCHEMBL408787 0.88 MAPT (0.35) MAPTNPSR1MEN1APAF1NPC1
Sulfuric Acid SCHEMBL1293162 0.86 MAPT (0.34) MAPTNPSR1MEN1APAF1NPC1
SCHEMBL412540 0.84 MAPT (0.33) MAPTNPSR1MEN1APAF1NPC1
SCHEMBL9935642 0.83 FDPS (0.31) FDPS
Propane SCHEMBL29165671 0.83 MEN1 (0.45) MAPTNPSR1MEN1APAF1NPC1
SCHEMBL305714 0.82 LMNA (0.33) MAPTNPSR1MEN1APAF1NPC1
SCHEMBL9936316 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2598593-B1 USE OF IONIC LIQUIDS WITH A CONTENT OF IONIC POLYMERS BASF SE (DE) 2014-04-23 EP disclosed
US-8703670-B2 Ionic liquids having a content of ionic polymers BASF SE (DE) 2014-04-22 US disclosed
US-20120021957-A1 IONIC LIQUIDS HAVING A CONTENT OF IONIC POLYMERS BASF SE (DE) 2012-01-26 US disclosed