SCHEMBL6652881

SCHEMBL6652881

CC(C)(C)OC(=O)NC(C(=O)c1ccc(N2CCN(Cc3ccccc3)CC2)cc1)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TSHR P16473 2/20 0.50
MAPK1 P28482 2/20 0.50
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HSD17B10 Q99714 3/20 0.48
KMT2A Q03164 1/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL6652883 1.00 MAPT (0.52) MAPTL3MBTL1TSHRMAPK1HTR2A
SCHEMBL6683479 0.85 CA1 (0.46) MAPTHTR2AHTR2CHTR2BLMNA
SCHEMBL6683480 0.85 CA1 (0.46) MAPTHTR2AHTR2CHTR2BLMNA
SCHEMBL6762193 0.83 CTSK (0.46) MAPTTSHRLMNASMN1; SMN2HSD17B10
SCHEMBL6762191 0.83 CTSK (0.46) MAPTTSHRLMNASMN1; SMN2HSD17B10
SCHEMBL9408000 0.81 MAPT (0.59) MAPTL3MBTL1TSHRMAPK1HTR2A
SCHEMBL6760302 0.81 MAPT (0.49) MAPTMAPK1LMNASMN1; SMN2KMT2A
SCHEMBL6760301 0.81 MAPT (0.49) MAPTMAPK1LMNASMN1; SMN2KMT2A
SCHEMBL6755717 0.81 RAB9A (0.53) MAPTL3MBTL1TSHRLMNASMN1; SMN2
SCHEMBL6755720 0.81 RAB9A (0.53) MAPTL3MBTL1TSHRLMNASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000061134-A9 ANTIMICROBIAL AGENTS BRITISH BIOTECH PHARM (GB) 2004-04-22 WO disclosed
US-6716878-B1 BACTERICIDE, ANTIPROTOZOAL; VANCOMYCIN RESISTANT ENTEROCOCCI AND BETA-LACTAM ANTIBIOTIC-RESISTANT BACTERIA, METHICILLIN-RESISTANT STAPHYLOCOCCUS AUREUS; HYDROXAMIC ACID AND N-FORMYL SUBTITUTED ALKYLAMIDES VERNALIS (OXFORD) LIMITED (GB) 2004-04-06 US disclosed
EP-1169031-A1 ANTIMICROBIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2002-01-09 EP disclosed
WO-2000061134-A1 ANTIMICROBIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-10-19 WO disclosed