SCHEMBL7651139

SCHEMBL7651139

CC(C)C(=O)OOC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HDAC1 Q13547 1/20 0.46
SRD5A2 P31213 1/20 0.44
TNF P01375 1/20 0.44
KLF5 Q13887 1/20 0.44
NOD1 Q9Y239 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PRSS1 P07477 1/20 0.42
ACR P10323 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
APEX1 P27695 1/20 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
SCHEMBL5987317 0.87 HDAC1 (0.57) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL10634213 0.85 HDAC1 (0.55) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7624106 0.80 MAPT (0.50) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7649397 0.80 TDP1 (0.53) MAPTTDP1MEN1KMT2ANPSR1
SCHEMBL9878491 0.80 TDP1 (0.69) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7634900 0.80 CA1 (0.44) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL8385932 0.79 HDAC1 (0.53) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7627465 0.79 HDAC1 (0.53) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7652795 0.79 ALDH1A1 (0.54) MAPTL3MBTL1CA1CA2MEN1
SCHEMBL7648805 0.79 ADRB2 (0.49) MAPTCA1CA2MEN1KMT2A

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
US-6491903-B1 NARROW MOLECULAR WEIGHT DISTRIBUTION SHELL-CORE POLYMERS HAVING HYDROPHILIC, CROSSLINKED PERMEABLE SHELLS AND HYDROPHOBIC CORES, USED FOR REDUCING BLOOD CHOLESTEROL AND BILE ACID UPTAKE IN INTERSTINES; DRUG DELIVERY WASHINGTON UNIVERSITY 2002-12-10 US disclosed
US-6383500-B1 Particles comprising amphiphilic copolymers, having a crosslinked shell domain and an interior core domain, useful for pharmaceutical and other applications WASHINGTON UNIVERSITY 2002-05-07 US disclosed
EP-0910351-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-28 EP disclosed
WO-1997049387-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed