SCHEMBL8399254

SCHEMBL8399254

Cc1ccc(C(=O)CCCCCCCCC(=O)c2ccc(C)c(N)c2)cc1N

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
HSD17B3 P37058 6/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 1/20 0.46
HDAC1 Q13547 5/20 0.45
HDAC8 Q9BY41 4/20 0.45
HDAC3 O15379 3/20 0.45
HDAC4 P56524 3/20 0.45
HDAC7 Q8WUI4 3/20 0.45
HDAC2 Q92769 3/20 0.45
HDAC10 Q969S8 3/20 0.45
HDAC11 Q96DB2 3/20 0.45
HDAC6 Q9UBN7 3/20 0.45
HDAC9 Q9UKV0 3/20 0.45
HDAC5 Q9UQL6 3/20 0.45
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
STS P08842 3/20 0.41

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
SCHEMBL27939427 0.94 HSD17B3 (0.57) MAPTTDP1HSD17B3STS
SCHEMBL8591650 0.89 MAPT (0.50) MAPTTDP1HSD17B3L3MBTL1LMNA
SCHEMBL24403947 0.86 MAPT (0.61) MAPTTDP1HSD17B3L3MBTL1NPC1
SCHEMBL11352711 0.84 MAPT (0.59) MAPTTDP1L3MBTL1LMNARAB9A
SCHEMBL7049515 0.81 MAPT (0.66) MAPTTDP1L3MBTL1LMNANPC1
SCHEMBL8680479 0.80 HSD17B3 (0.51) MAPTTDP1HSD17B3L3MBTL1LMNA
SCHEMBL8960208 0.79 MAPT (0.61) MAPTTDP1L3MBTL1LMNANPC1
SCHEMBL9078392 0.77 HSD17B3 (0.59) MAPTHSD17B3STS
SCHEMBL7390784 0.77 HSD17B3 (0.45) MAPTTDP1HSD17B3L3MBTL1LMNA
SCHEMBL29180345 0.77 HSD17B3 (0.45) MAPTTDP1HSD17B3L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5859067-A PREPARING BIS(2-HYDROXY-1-NAPHTHYL)DECANE FROM THE CORRESPONDING DIACID; FORMING ACID DICHLORIDE; TREATING WITH 2-NAPHTHOL; REARRANGEMENT; REDUCTION; INHIBITS ACTION OF ADENOSINE TRIPHOSPHATASE ROUFOGALIS BASIL DON (AU) 1999-01-12 US disclosed
US-5741821-A PHENOLIC ENZYME INHIBITORS THE UNIVERSITY OF SYDNEY (AU) 1998-04-21 US disclosed
WO-1994028886-A1 USE OF NATURAL PRODUCTS AND RELATED SYNTHETIC COMPOUNDS FOR THE TREATMENT OF CARDIOVASCULAR DISEASE THE UNIVERSITY OF SYDNEY (AU) 1994-12-22 WO disclosed