SCHEMBL30487284

SCHEMBL30487284

O=Cc1cn(Cc2cccc(F)c2)c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 1.00
SMN1; SMN2 Q16637 7/20 1.00
LMNA P02545 6/20 1.00
TDP1 Q9NUW8 3/20 1.00
HTT P42858 6/20 0.73
KMT2A Q03164 6/20 0.66
MEN1 O00255 5/20 0.66
POLB P06746 2/20 0.58
ALPG P10696 1/20 0.58
DNMT1 P26358 1/20 0.58
DUSP3 P51452 1/20 0.58
CASP6 P55212 1/20 0.58
MAPT P10636 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
MGAM O43451 1/20 0.54
GAA P10253 1/20 0.54
SI P14410 1/20 0.54
MGAM2 Q2M2H8 1/20 0.54
CYP19A1 P11511 1/20 0.53
HSP90AA1 P07900 1/20 0.52

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
SCHEMBL29071626 1.00 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL28900440 0.85 ALDH1A1 (0.75) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL14222891 0.85 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL8690446 0.85 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL29377589 0.84 ALDH1A1 (0.78) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL1418988 0.84 ALDH1A1 (0.78) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL4361317 0.84 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL30487285 0.84 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL8685876 0.84 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2LMNATDP1HTT
SCHEMBL8685326 0.84 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2LMNATDP1HTT

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
CN-116535386-B Cyanoethylene sulfonyl anilide compound and preparation method and medical application thereof 西南大学 2025-05-27 CN disclosed
CN-116535386-A Cyanoethylene sulfonyl anilide compound and preparation method and medical application thereof 西南大学 2023-08-04 CN disclosed