SCHEMBL29090925

SCHEMBL29090925

COc1ccc(C=CC(C)=O)cc1F

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 7/20 0.66
APP P05067 3/20 0.65
FDPS P14324 1/20 0.64
GAA P10253 1/20 0.57
HTT P42858 1/20 0.57
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HSD17B10 Q99714 1/20 0.55
NFE2L2 Q16236 1/20 0.54
JUN P05412 1/20 0.54
NFKB1 P19838 1/20 0.54
MCL1 Q07820 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ABCG2 Q9UNQ0 1/20 0.53

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
SCHEMBL24164775 1.00 TUBB1 (0.66) TUBB1APPFDPSGAAHTT
SCHEMBL30548412 1.00 TUBB1 (0.66) TUBB1APPFDPSGAAHTT
SCHEMBL584263 0.87 KDM4E (0.73) TUBB1GAAHTTKDM4EALDH1A1
SCHEMBL22391534 0.87 APP (0.69) TUBB1APPFDPSGAAHTT
SCHEMBL584262 0.87 KDM4E (0.73) TUBB1GAAHTTKDM4EALDH1A1
SCHEMBL27092069 0.87 APP (0.69) TUBB1APPFDPSGAAHTT
SCHEMBL6821280 0.86 EPHX2 (0.66) TUBB1APPFDPSGAAHTT
SCHEMBL6818628 0.86 TUBB1 (0.64) TUBB1KDM4EALDH1A1HPGDALOX15
SCHEMBL6818632 0.86 TUBB1 (0.64) TUBB1KDM4EALDH1A1HPGDALOX15
Hydrochloric Acid SCHEMBL6818633 0.86 KDM4E (0.71) TUBB1GAAHTTKDM4EALDH1A1

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
CN-116745467-A Composition for tin or tin alloy electroplating comprising a leveling agent 巴斯夫欧洲公司 2023-09-12 CN disclosed