SCHEMBL7049489

SCHEMBL7049489

C=Cn1ccnc1CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
FPR2 P25090 1/20 0.33
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAPT P10636 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 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
SCHEMBL30864242 0.80 TBXAS1 (0.38) LMNATDP1GAASMN1; SMN2MAPT
Bromide SCHEMBL28606189 0.79 TBXAS1 (0.37) LMNATDP1GAASMN1; SMN2MAPT
Acetic Acid SCHEMBL22470758 0.78 LMNA (0.38) LMNATDP1GAASMN1; SMN2CYP3A4
SCHEMBL5961221 0.77
SCHEMBL31154491 0.76 FPR2 (0.39) SMN1; SMN2FPR2ESR1
Bromide SCHEMBL28888206 0.74 LMNA (0.43) LMNATDP1GAASMN1; SMN2CYP3A4
SCHEMBL29250811 0.74 LMNA (0.43) LMNATDP1GAASMN1; SMN2CYP3A4
SCHEMBL6497007 0.73 FPR2 (0.35) SMN1; SMN2CYP2C19FPR2KDM4ECYP1A2
SCHEMBL367172 0.73 LMNA (0.46) LMNATDP1GAASMN1; SMN2CYP3A4
SCHEMBL29250854 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103265492-B Chlorinated 1-vinyl-3-carboxymethyl imidazole polymerizable acidic ionic liquid and synthetic method thereof UNIV NORTHWESTERN POLYTECHNIC 2015-04-01 CN claimed
CN-103265492-A Chlorinated 1-vinyl-3-carboxymethyl imidazole polymerizable acidic ionic liquid and synthetic method thereof UNIV NORTHWESTERN POLYTECHNIC 2013-08-28 CN claimed
CN-103265492-B Chlorinated 1-vinyl-3-carboxymethyl imidazole polymerizable acidic ionic liquid and synthetic method thereof UNIV NORTHWESTERN POLYTECHNIC 2015-04-01 CN disclosed
CN-103265492-A Chlorinated 1-vinyl-3-carboxymethyl imidazole polymerizable acidic ionic liquid and synthetic method thereof UNIV NORTHWESTERN POLYTECHNIC 2013-08-28 CN disclosed
WO-2003018650-A1 USE OF AMPHOTERIC POLYMERS AS ADDITIVES PROMOTING DIRT SEPARATION FOR SURFACE CONDITIONING BASF AKTIENGESELLSCHAFT (DE) 2003-03-06 WO disclosed