SCHEMBL28899504

SCHEMBL28899504

Oc1ccc2cccn2c1O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.33
GAA P10253 3/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GLA P06280 2/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
IDO1 P14902 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
LMNA P02545 1/20 0.30
MPI P34949 1/20 0.30

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
SCHEMBL277147 0.70 ALOX15 (0.36) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL1155337 0.64 KDM4E (0.37) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL8404412 0.62 ALOX15 (0.39) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL29769929 0.60 ALDH1A1 (0.47) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL1958088 0.60 ALDH1A1 (0.47) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL9900893 0.60 ADORA3 (0.43) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL277146 0.60 ALOX15 (0.36) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL19947884 0.60 KDM4E (0.38) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL16924635 0.59 ALOX15 (0.40) ALOX15GAAKDM4EALDH1A1GLA
SCHEMBL277389 0.59 ALOX15 (0.40) ALOX15GAAKDM4EALDH1A1GLA

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-115252514-A A facial mask for treating pigmentation speckle and whitening skin 四川泽南世家生物科技有限公司 2022-11-01 CN disclosed