SCHEMBL2811793

SCHEMBL2811793

CCS(=O)(=O)O.COS(=O)(=O)[O-].C[N+](C)(C)c1ccccc1

nearest known ligand 0.50

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 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.50
BCHE P06276 2/20 0.50
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 2/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
HTR1A P08908 1/20 0.33
MAOA P21397 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KCNH2 Q12809 1/20 0.33
PSIP1 O75475 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
SCHEMBL2531547 0.89 APOBEC3A (0.56) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
SCHEMBL331180 0.88 APOBEC3A (0.58) ACHEBCHEAPOBEC3AAPOBEC3GKDM4E
Dodecane SCHEMBL27419560 0.85 BCHE (0.46) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
Acetamide SCHEMBL27397023 0.83 ACHE (0.53) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
SCHEMBL27602968 0.82 APOBEC3A (0.56) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
Sulfuric Acid SCHEMBL5345728 0.82 APOBEC3A (0.61) ACHEBCHEAPOBEC3AAPOBEC3GALDH1A1
SCHEMBL331179 0.80 APOBEC3A (0.58) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
SCHEMBL9367158 0.78 BCHE (0.47) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
Sulfuric Acid SCHEMBL27613503 0.78 APOBEC3A (0.56) ACHEBCHEAPOBEC3AAPOBEC3GLMNA
Sulfuric Acid SCHEMBL2386162 0.78 APOBEC3A (0.67) ACHEBCHEAPOBEC3AAPOBEC3GALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207416-B1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM IMERYS FILTRATION MINERALS INC (US) 2018-11-07 EP disclosed
US-20100239679-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM WORLD MINERALS, INC. (US) 2010-09-23 US disclosed
EP-2207416-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM World Minerals, Inc. (US) 2010-07-21 EP disclosed
WO-2009045941-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM WORLD MINERALS, INC. (US) 2009-04-09 WO disclosed