SCHEMBL30714711

SCHEMBL30714711

CC1(C)c2ccccc2-c2ccc(-c3ccccc3)cc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 16/20 0.56
MEN1 O00255 1/20 0.44
APAF1 O14727 1/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
XBP1 P17861 1/20 0.44
PTBP1 P26599 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
GALK1 P51570 1/20 0.44
BLM P54132 1/20 0.44
SMAD3 P84022 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TDP2 O95551 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
SCHEMBL29549175 1.00 PDK2 (0.56) PDK2MEN1APAF1NPC1LMNA
SCHEMBL12520490 1.00 PDK2 (0.56) PDK2MEN1APAF1NPC1LMNA
SCHEMBL30297640 0.96 PDK2 (0.53) PDK2MEN1APAF1NPC1LMNA
SCHEMBL30009790 0.96 PDK2 (0.50) PDK2
SCHEMBL1649136 0.94 PDK2 (0.47) PDK2
SCHEMBL2961503 0.90 PDK2 (0.45) PDK2
SCHEMBL30452272 0.90 PDK2 (0.45) PDK2
SCHEMBL7141200 0.90 PDK2 (0.49) PDK2MEN1APAF1NPC1LMNA
SCHEMBL23097280 0.90 PDK2 (0.48) PDK2MEN1APAF1NPC1LMNA
SCHEMBL10029843 0.90 PDK2 (0.48) PDK2MEN1APAF1NPC1LMNA

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-2023239406-A2 POLYVINYL TOLUENE SCINTILLATORS PRODUCED USING CATIONIC PHOTOINITIATORS FOR ADDITIVELY MANUFACTURED RADIATION DETECTORS LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) 2023-12-14 WO disclosed