SCHEMBL7258485

SCHEMBL7258485

C=Cc1ccncc1.CC(=CCCN(C)C)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.35
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TBXAS1 P24557 4/20 0.33
BCL2L1 Q07817 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SNCA P37840 1/20 0.32
JUN P05412 1/20 0.32
NFKB1 P19838 1/20 0.32
AKR1C3 P42330 1/20 0.32
PPARG P37231 1/20 0.32
HTT P42858 1/20 0.31

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
Styrene SCHEMBL5498948 0.87 AKR1C3 (0.45) BCHEKDM4EBCL2L1SMN1; SMN2AKR1C3
SCHEMBL4407600 0.85 TBXAS1 (0.35) TBXAS1SMN1; SMN2SNCAJUNNFKB1
SCHEMBL15637663 0.85 TBXAS1 (0.35) TBXAS1SMN1; SMN2SNCAJUNNFKB1
SCHEMBL6352251 0.78 CHRM2 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8519714 0.78 JUN (0.40) KDM4ETBXAS1SMN1; SMN2SNCAJUN
SCHEMBL3802153 0.78 JUN (0.40) KDM4ETBXAS1SMN1; SMN2SNCAJUN
SCHEMBL22600 0.77 CD81 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL30875818 0.77 CD81 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL112617 0.77 CD81 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
Iodide SCHEMBL16012390 0.76 JUN (0.39) TBXAS1SMN1; SMN2SNCAJUNNFKB1

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
US-6624219-B1 Acrylic acid-styrene-vinylpyridine terpolymer and monoazo, anthraquinone or quinophthalone dye nanoparticles in water BASF AKTIENGESELLSCHAFT (DE) 2003-09-23 US disclosed
EP-1328561-A2 SURFACE ACTIVE RANDOM RADICAL (CO)POLYMER AND DISPERSION METHOD FOR USING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2003-07-23 EP disclosed
WO-2002014391-A2 SURFACE ACTIVE RANDOM RADICAL (CO)POLYMER AND DISPERSION METHOD FOR USING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2002-02-21 WO disclosed