SCHEMBL8058900

SCHEMBL8058900

C=CCNC(O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MTOR P42345 1/20 0.39
RAB9A P51151 1/20 0.39
GRM7 Q14831 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 1/20 0.39
GAA P10253 1/20 0.39
AOC3 Q16853 3/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
POLB P06746 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
SCHEMBL10582023 0.79 SMN1; SMN2 (0.46) SMN1; SMN2CYP2C19KDM4EL3MBTL1MTOR
SCHEMBL6724867 0.79 MTOR (0.58) SMN1; SMN2CYP2C19KDM4EL3MBTL1MTOR
SCHEMBL9408913 0.79 HDAC4 (0.41) LMNA
SCHEMBL31620151 0.78 CYP2D6 (0.55) CYP2C19KDM4EALDH1A1LMNAHPGD
SCHEMBL13910061 0.78 SLC6A4 (0.40) SMN1; SMN2CYP2C19KDM4EL3MBTL1ALDH1A1
SCHEMBL6389932 0.77 SMN1; SMN2 (0.49) SMN1; SMN2CYP2C19KDM4EL3MBTL1ALDH1A1
SCHEMBL9408910 0.77 KDM4E (0.38) CYP2C19KDM4EL3MBTL1MTORRAB9A
SCHEMBL19692678 0.77 KDM4E (0.45) CYP2C19KDM4EL3MBTL1MTORRAB9A
Hydrochloric Acid SCHEMBL18553839 0.77 MEN1 (0.40) SMN1; SMN2CYP2C19KDM4EALDH1A1LMNA
SCHEMBL29650956 0.76 MTOR (0.58) SMN1; SMN2CYP2C19KDM4EL3MBTL1MTOR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0998448-A1 NOVEL N-ALKYL-HYDROXYBENZYLAMINES, PREPARATION METHOD, USES AND COMPOSITIONS CONTAINING THEM CFPI INDUSTRIES (FR) 2000-05-10 EP claimed
WO-1999005089-A1 NOVEL N-ALKYL-HYDROXYBENZYLAMINES, PREPARATION METHOD, USES AND COMPOSITIONS CONTAINING THEM CFPI INDUSTRIES (FR) 1999-02-04 WO claimed
EP-0998448-A1 NOVEL N-ALKYL-HYDROXYBENZYLAMINES, PREPARATION METHOD, USES AND COMPOSITIONS CONTAINING THEM CFPI INDUSTRIES (FR) 2000-05-10 EP disclosed
EP-0998448-A1 NOVEL N-ALKYL-HYDROXYBENZYLAMINES, PREPARATION METHOD, USES AND COMPOSITIONS CONTAINING THEM CFPI INDUSTRIES (FR) 2000-05-10 EP disclosed
WO-1999005089-A1 NOVEL N-ALKYL-HYDROXYBENZYLAMINES, PREPARATION METHOD, USES AND COMPOSITIONS CONTAINING THEM CFPI INDUSTRIES (FR) 1999-02-04 WO disclosed
WO-1999005089-A1 NOVEL N-ALKYL-HYDROXYBENZYLAMINES, PREPARATION METHOD, USES AND COMPOSITIONS CONTAINING THEM CFPI INDUSTRIES (FR) 1999-02-04 WO disclosed