SCHEMBL5285827

SCHEMBL5285827

CCCCn1cc[n+](C)c1.CCS(=O)(=O)[O-]

nearest known ligand 0.77

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 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.65
HSP90AA1 P07900 2/20 0.65
KMT2A Q03164 2/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
APAF1 O14727 1/20 0.65
NPC1 O15118 1/20 0.65
PLA2G1B P04054 1/20 0.65
MAPT P10636 1/20 0.65
MAPK1 P28482 1/20 0.65
HTT P42858 1/20 0.65
RAB9A P51151 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
ATG4B Q9Y4P1 1/20 0.65
FDPS P14324 17/20 0.42

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
Sulfuric Acid SCHEMBL2993814 0.95 MEN1 (0.67) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL1716024 0.94 MEN1 (0.76) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL294165 0.93 MEN1 (0.65) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL2357881 0.92 MEN1 (0.59) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL7742082 0.92 MEN1 (0.59) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Sulfuric Acid SCHEMBL582395 0.92 MEN1 (0.63) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Sulfuric Acid SCHEMBL27783819 0.90 MEN1 (0.61) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL28478541 0.90 MEN1 (0.65) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL4023088 0.90 MEN1 (0.65) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL305739 0.89 MEN1 (0.59) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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-108885367-B Polarizing plate and liquid crystal display including the same 株式会社LG化学 2021-09-07 CN disclosed
WO-2007006389-A1 MIXTURE OF ONIUM ALKYL SULFONATES AND ONIUM ALKYL SULFITES MERCK PATENT GMBH (DE) 2007-01-18 WO disclosed