SCHEMBL8740559

SCHEMBL8740559

CCCCCCCC1(CCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc4c(c3)C(CCCCCCBr)(CCCCCCBr)c3cc(C)ccc3-4)cc21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.39
CNR2 P34972 11/20 0.39
ICMT O60725 2/20 0.33
PDK2 Q15119 2/20 0.32
RARB P10826 1/20 0.32
TLR8 Q9NR97 1/20 0.31
PTPN11 Q06124 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL12402041 0.92 PDK2 (0.39) CNR1CNR2ICMTPDK2
SCHEMBL16204111 0.89 PDK2 (0.35) CNR1CNR2PDK2
SCHEMBL16625772 0.89 PDK2 (0.35) CNR1CNR2PDK2
SCHEMBL12402033 0.88 PDK2 (0.43) CNR1CNR2ICMTPDK2RAB9A
SCHEMBL25363124 0.87 PDK2 (0.41) CNR1CNR2ICMTPDK2RARB
SCHEMBL26050718 0.87 CNR1 (0.40) CNR1CNR2PDK2TLR8NPC1
SCHEMBL19442933 0.87 CNR1 (0.40) CNR1CNR2PDK2TLR8NPC1
SCHEMBL13231046 0.87 CNR2 (0.38) CNR1CNR2ICMTPDK2TLR8
SCHEMBL12402039 0.87 PGR (0.44) CNR2ICMTPDK2RAB9A
SCHEMBL12143157 0.86 CNR1 (0.36) CNR1CNR2ICMTPDK2TLR8

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
US-20120129258-A1 CELL CHIP AND METHOD OF FABRICATING THE SAME ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2012-05-24 US disclosed