SCHEMBL14456207

SCHEMBL14456207

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

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.45
▸ LMNA P02545 3/20 0.45
▸ GAA P10253 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KMT2A Q03164 7/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL13609924 1.00 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL4547548 1.00 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL10972015 0.92 ALDH1A1 (0.41) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL13879916 0.90 POLB (0.38) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL21128717 0.89 ALDH1A1 (0.43) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL18415027 0.89 ALDH1A1 (0.46) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL12864658 0.89 ALDH1A1 (0.46) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL22453309 0.89 ALDH1A1 (0.43) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL14354774 0.88 ALDH1A1 (0.42) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL14097777 0.88 KDM4E (0.40) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244859-B2 Method for producing δ-aminopentadienoate derivatives FUJIFILM CORPORATION (JP) 2007-07-17 — — US disclosed
US-7244859-B2 Method for producing δ-aminopentadienoate derivatives FUJIFILM CORPORATION (JP) 2007-07-17 — — US disclosed
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