SCHEMBL20600129

SCHEMBL20600129

CC(O)CCN1CCC[C@H]1C(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
LMNA P02545 4/20 0.50
CHRM3 P20309 1/20 0.43
KCNH2 Q12809 3/20 0.43
HRH1 P35367 3/20 0.42
HTR2A P28223 2/20 0.42
DRD3 P35462 2/20 0.42
HTR2B P41595 2/20 0.42
BLM P54132 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
CACNA1F O60840 1/20 0.42
GMNN O75496 1/20 0.42
USP2 O75604 1/20 0.42
EGFR P00533 1/20 0.42
CYP1A2 P05177 1/20 0.42
FYN P06241 1/20 0.42
CHRM2 P08172 1/20 0.42
ABCB1 P08183 1/20 0.42

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
SCHEMBL20600132 1.00 ATM (0.51) ATML3MBTL1LMNACHRM3KCNH2
SCHEMBL8342637 0.85 LMNA (0.53) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8343216 0.85 LMNA (0.53) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8339348 0.85 LMNA (0.53) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8339280 0.84 LMNA (0.56) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8336619 0.84 LMNA (0.56) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8336623 0.84 LMNA (0.56) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8481946 0.82 LMNA (0.51) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8477474 0.82 LMNA (0.51) ATML3MBTL1LMNACHRM3HRH1
SCHEMBL8477470 0.82 LMNA (0.51) ATML3MBTL1LMNACHRM3HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019001712-A1 NEW TRIDENTATE POLYMERIZATION CATALYSTS GEORG-AUGUST-UNIVERSITAET GOETTINGEN STIFTUNG OEFFENTLICHEN RECHTS (DE) 2019-01-03 WO disclosed