SCHEMBL7647666

SCHEMBL7647666

O=C(OOC(=O)[C@@H]1C[C@@H]2CC[C@H]1C2)[C@@H]1C[C@@H]2CC[C@H]1C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.43
HSD11B1 P28845 1/20 0.42
HPGD P15428 3/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNQ4 P56696 1/20 0.40
KCNQ5 Q9NR82 1/20 0.40
MEN1 O00255 2/20 0.39
HTT P42858 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
P2RX7 Q99572 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7647668 1.00 POLB (0.52) POLBL3MBTL1HSD11B1HPGDKCNQ3
SCHEMBL2515949 0.86 POLB (0.52) POLBL3MBTL1HSD11B1HPGDKCNQ3
SCHEMBL7593658 0.84 POLB (0.50) POLBL3MBTL1HSD11B1HPGDKCNQ3
SCHEMBL1105066 0.83 POLB (0.53) POLBL3MBTL1HSD11B1KCNQ3KCNQ2
SCHEMBL28611784 0.83 POLB (0.48) POLBL3MBTL1HSD11B1HPGDKCNQ3
SCHEMBL34462074 0.83 POLB (0.53) POLBL3MBTL1HSD11B1KCNQ3KCNQ2
SCHEMBL18628997 0.83 POLB (0.53) POLBL3MBTL1HSD11B1KCNQ3KCNQ2
SCHEMBL17518655 0.83 POLB (0.53) POLBL3MBTL1HSD11B1KCNQ3KCNQ2
SCHEMBL32689262 0.81 POLB (0.47) POLBL3MBTL1HSD11B1HPGDKCNQ3
SCHEMBL21174561 0.79 POLB (0.46) POLBL3MBTL1HSD11B1HPGDKCNQ3

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 2 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