SCHEMBL31499008

SCHEMBL31499008

Oc1ccc(/C=N/n2cn[nH]c2=S)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.73
HPGD P15428 4/20 0.73
GAA P10253 4/20 0.73
ALOX15 P16050 2/20 0.73
NPSR1 Q6W5P4 2/20 0.73
APOBEC3G Q9HC16 1/20 0.73
MAPT P10636 7/20 0.64
SMN1; SMN2 Q16637 4/20 0.61
KDM4E B2RXH2 3/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
TDP1 Q9NUW8 1/20 0.55
GFER P55789 3/20 0.54
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MCL1 Q07820 2/20 0.50

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
SCHEMBL28558439 1.00 ALDH1A1 (0.73) ALDH1A1HPGDGAAALOX15NPSR1
SCHEMBL28645789 0.69 GAA (0.87) ALDH1A1HPGDGAAAPOBEC3GSMN1; SMN2
SCHEMBL28867947 0.68 AMY1A (0.53) ALDH1A1GAANPSR1MAPTSMN1; SMN2
SCHEMBL24727973 0.67 AMY1A (1.00) ALDH1A1HPGDNPSR1MAPTSMN1; SMN2
SCHEMBL28558508 0.67 GAA (0.71) ALDH1A1HPGDGAAAPOBEC3GMAPT
SCHEMBL11243927 0.67 AMY1A (0.56) ALDH1A1GAANPSR1MAPTSMN1; SMN2
SCHEMBL11243922 0.67 AMY1A (0.56) ALDH1A1GAANPSR1MAPTSMN1; SMN2
SCHEMBL28556427 0.66 GAA (0.58) ALDH1A1HPGDGAAAPOBEC3GMAPT
SCHEMBL9427819 0.66 TDP1 (0.64) ALDH1A1NPSR1MAPTRAB9ATDP1
SCHEMBL8497576 0.60 MAPT (1.00) ALDH1A1HPGDGAAALOX15MAPT

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-119431256-A Substituted hydroxy-phenylimine compound, preparation and application thereof 中国农业大学 2025-02-14 CN disclosed