SCHEMBL21490934

SCHEMBL21490934

CCOC(=O)C(=CC=CN)S(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ LMNA P02545 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ KMT2A Q03164 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ TSHR P16473 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ CA12 O43570 3/20 0.37
▸ CA1 P00915 3/20 0.37
▸ CA2 P00918 3/20 0.37
▸ CA9 Q16790 3/20 0.37
▸ CYP2C9 P11712 1/20 0.37

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
SCHEMBL12864658 0.84 ALDH1A1 (0.46) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL18415027 0.84 ALDH1A1 (0.46) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL16215837 0.83 ALDH1A1 (0.50) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL14456207 0.83 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL13609924 0.83 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL4547548 0.83 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL31575386 0.82 ALDH1A1 (0.47) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL10098365 0.81 ALDH1A1 (0.56) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL16317952 0.80 ALDH1A1 (0.43) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL21128717 0.80 ALDH1A1 (0.43) ALDH1A1LMNAGAAHPGDSMN1; SMN2

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
US-20190321280-A1 MEMORY SHAPE SUNSCREEN COMPOSITION L'OREAL (FR) 2019-10-24 — — US disclosed
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