SCHEMBL7574293

SCHEMBL7574293

CCCCOC(=O)C(CC)N(C(C)=O)c1cccc(F)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 6/20 0.40
RAB9A P51151 3/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.40
NPC1 O15118 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PTBP1 P26599 1/20 0.40
HTT P42858 1/20 0.40
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SLC6A9 P48067 1/20 0.35
KMT2A Q03164 1/20 0.35
FAAH O00519 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
SCHEMBL7571050 0.86 LMNA (0.40) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL7573703 0.85 LTB4R2 (0.44) LTB4R2HPGDALDH1A1HTTFAAH
SCHEMBL7569876 0.85 FAAH (0.39) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL7573230 0.85 TSHR (0.45) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL7571829 0.85 GAA (0.44) SMN1; SMN2ALDH1A1TSHRTDP1L3MBTL1
SCHEMBL7879014 0.84 ALDH1A1 (0.38) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL7570696 0.82 ALDH1A1 (0.43) LMNASMN1; SMN2ALDH1A1HTTTDP1
SCHEMBL7567342 0.81 CETP (0.40) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL6136582 0.81 ALDH1A1 (0.42) LTB4R2RAB9ALMNANPC1SMN1; SMN2
SCHEMBL8599745 0.80 ESR1 (0.39) RAB9ALMNAHPGDNPC1SMN1; 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
WO-1998022494-A9 METHODS AND COMPOUNDS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR SYNTHESIS 1998-08-20 WO disclosed