SCHEMBL5082298

SCHEMBL5082298

O=S(=O)(O)CCc1nc2ccccc2[nH]1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
LMNA P02545 2/20 0.63
GAA P10253 1/20 0.63
KMT2A Q03164 1/20 0.63
CHRM1 P11229 1/20 0.62
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
PDE10A Q9Y233 1/20 0.56
HTT P42858 1/20 0.56
KDM4E B2RXH2 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
DDAH1 O94760 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL4015086 0.90 POLB (0.70) POLBLMNAGAAKMT2ACHRM1
SCHEMBL29632074 0.90 POLB (0.70) POLBLMNAGAAKMT2ACHRM1
SCHEMBL5067127 0.89 POLB (0.73) POLBLMNAGAAKMT2ACHRM1
SCHEMBL10767475 0.83 POLB (0.59) POLBLMNAGAAKMT2ACHRM1
SCHEMBL10768086 0.83 POLB (0.55) POLBLMNAGAAKMT2ACHRM1
SCHEMBL5069923 0.83 L3MBTL1 (0.59) POLBLMNAGAAKMT2ACHRM1
SCHEMBL230157 0.82 POLB (0.84) POLBGAACHRM1NPC1RAB9A
SCHEMBL21797162 0.81 POLB (0.57) POLBLMNAGAAKMT2ACHRM1
Sulfuric Acid SCHEMBL11014852 0.79 POLB (0.67) POLBLMNACHRM1KDM4EDDAH1
SCHEMBL21797171 0.79 POLB (0.62) POLBLMNAGAAKMT2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080032173-A1 Hydrocarbon type polymer electrolyte, membrane/electrode assembly, and fuel cell power source HITACHI, LTD. (JP) 2008-02-07 US disclosed