SCHEMBL28545338

SCHEMBL28545338

CC(CCCCCCOC(=O)c1ccc(N)cc1)COC(=O)c1ccc(N)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.65
NPC1 O15118 2/20 0.65
RAB9A P51151 2/20 0.65
ALDH1A1 P00352 1/20 0.65
LMNA P02545 3/20 0.60
CYP1A2 P05177 3/20 0.60
CYP3A4 P08684 3/20 0.60
TSHR P16473 2/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
PDE4D Q08499 1/20 0.60
SCN1A P35498 2/20 0.53
SCN2A Q99250 2/20 0.53
SCN3A Q9NY46 2/20 0.53
CYP2D6 P10635 2/20 0.52
ADRB2 P07550 2/20 0.52
ADRB1 P08588 2/20 0.52
ADRB3 P13945 2/20 0.52
CHRM2 P08172 1/20 0.52
HTR1A P08908 1/20 0.52

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
SCHEMBL18037702 0.89 MAPT (0.58) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL10524703 0.87 NPC1 (0.70) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL7181837 0.87 NPC1 (0.70) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL17466183 0.86 TDP1 (0.65) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL29144932 0.85 NPC1 (0.68) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL18053324 0.85 NPC1 (0.59) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL7027777 0.83 ADRB2 (0.65) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL4334904 0.83 NPC1 (0.83) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL4558859 0.83 NPC1 (0.83) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL4345503 0.83 NPC1 (0.83) MAPTNPC1RAB9AALDH1A1LMNA

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
CN-112692725-A Composition for polishing pad and polishing pad SKC索密思株式会社 2021-04-23 CN disclosed