SCHEMBL7576535

SCHEMBL7576535

CCCCOC(=O)C(CC)NC(=O)Cc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
FAAH O00519 3/20 0.44
PPIA P62937 1/20 0.42
RAB9A P51151 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
ELOVL1 Q9BW60 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7571648 0.86 TSHR (0.41) FAAHLMNAKMT2AMEN1L3MBTL1
SCHEMBL4414999 0.84 ALDH1A1 (0.53) ALDH1A1RAB9ALMNAKMT2AMEN1
SCHEMBL7573224 0.82 CNR2 (0.58) ALDH1A1RAB9ALMNAKMT2AMEN1
SCHEMBL6136640 0.80 ALDH1A1 (0.57) ALDH1A1RAB9ALMNAKMT2AMEN1
SCHEMBL7569870 0.80 TDP1 (0.58) ALDH1A1FAAHRAB9ALMNAKMT2A
SCHEMBL7574286 0.80 CNR2 (0.46) FAAHTDP1KDM4ESMN1; SMN2
SCHEMBL7567337 0.78 ELANE (0.48) KMT2AMEN1L3MBTL1KDM4ESMN1; SMN2
SCHEMBL21659413 0.77 L3MBTL1 (0.50) ALDH1A1FAAHKMT2AMEN1L3MBTL1
SCHEMBL7570560 0.77 KMT2A (0.47) ALDH1A1RAB9AKMT2AMEN1L3MBTL1
SCHEMBL7567608 0.76 CASP1 (0.44) ALDH1A1RAB9AKMT2AMEN1L3MBTL1

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