SCHEMBL9521176

SCHEMBL9521176

C#CCCCOc1c(Cl)cc(-c2noc(C)n2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.39
TDP1 Q9NUW8 3/20 0.35
MAPT P10636 6/20 0.35
TSHR P16473 2/20 0.35
NPY1R P25929 1/20 0.35
NPY2R P49146 1/20 0.35
NR1I2 O75469 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 2/20 0.33
AOC3 Q16853 2/20 0.33
SLC6A4 P31645 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
HTT P42858 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL9201638 0.87 NR1I2 (0.46) L3MBTL1TDP1MAPTTSHRNR1I2
SCHEMBL9520899 0.82 CYP3A4 (0.44) L3MBTL1TDP1MAPTTSHRNR1I2
SCHEMBL9523124 0.82 CYP3A4 (0.44) L3MBTL1TDP1MAPTTSHRNR1I2
SCHEMBL9522122 0.78 AOC3 (0.50) L3MBTL1TDP1MAPTTSHRNR1I2
SCHEMBL9210194 0.76 NR1I2 (0.53) L3MBTL1TDP1MAPTTSHRNPY1R
SCHEMBL9520450 0.74 ACACB (0.46) L3MBTL1TDP1MAPTTSHRNPY1R
SCHEMBL9520566 0.74 NR1I2 (0.44) L3MBTL1TDP1MAPTTSHRNPY1R
SCHEMBL8138473 0.72 NR1I2 (0.66) NR1I2CYP3A4CYP2D6
SCHEMBL9522035 0.72 MAPT (0.35) L3MBTL1TDP1MAPTTSHRCYP3A4
SCHEMBL9521646 0.72 S1PR1 (0.50)

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
EP-0523803-A1 1,2,4-Oxadiazolyl-phenoxy-alkylisoxazoles and their use as antiviral agents STERLING WINTHROP INC. (US) 1993-01-20 EP disclosed
US-5175177-A 1,2,4-OXADIAZOLYL-PHENOXYALKYLISOXAZOLES AND THEIR USE AS ANTIVIRAL AGENTS STERLING DRUG INC. (US) 1992-12-29 US disclosed