SCHEMBL7656479

SCHEMBL7656479

Cc1csc(C(=O)OOC(=O)c2cc(C)cs2)c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.63
CASP3 P42574 2/20 0.38
SENP7 Q9BQF6 2/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
KDR P35968 3/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 1/20 0.35
GSK3B P49841 3/20 0.35
RAF1 P04049 1/20 0.33
CTPS1 P17812 1/20 0.32
HCAR3 P49019 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL131369 0.85 DAO (0.67) DAOCASP3SENP7SENP8SENP6
SCHEMBL28752248 0.83 DAO (0.59) DAOCASP3SENP7SENP8SENP6
SCHEMBL14269794 0.83 DAO (0.59) DAOCASP3SENP7SENP8SENP6
SCHEMBL6826976 0.82 DAO (0.57) DAOMAPTGSK3B
SCHEMBL27780583 0.80 DAO (0.55) DAOCASP3SENP7SENP8SENP6
SCHEMBL5292745 0.80 DAO (0.55) DAOCASP3SENP7SENP8SENP6
SCHEMBL5859674 0.79 DAO (0.71) DAOCASP3SENP7SENP8SENP6
SCHEMBL7368425 0.79 DAO (0.71) DAOCASP3SENP7SENP8SENP6
SCHEMBL8387289 0.79 DAO (0.41) DAOMAPTTP53
SCHEMBL27030518 0.77 DAO (0.52) DAOCASP3SENP7SENP8SENP6

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-0907666-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) 1999-04-14 EP disclosed
WO-1997049736-A2 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