SCHEMBL7630333

SCHEMBL7630333

CCCCC1CC[C](OOC(=O)c2ccc(C)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TLR4 O00206 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
HTR1A P08908 1/20 0.35
CHRM5 P08912 1/20 0.35
ADRA2A P08913 1/20 0.35
DRD2 P14416 1/20 0.35
ADRA2B P18089 1/20 0.35

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
SCHEMBL7634988 0.90 ALDH1A1 (0.39) TDP1TLR4KMT2AMEN1LMNA
SCHEMBL7631032 0.88 LMNA (0.44) TDP1KMT2AMEN1LMNACHRM1
SCHEMBL7629434 0.88 PLK1 (0.38) TLR4L3MBTL1CYP2C19CYP3A4CYP2D6
SCHEMBL7628002 0.88 HDAC3 (0.41) TDP1TLR4KMT2AMEN1L3MBTL1
SCHEMBL7627239 0.88 MAPT (0.43) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL7625785 0.88 RARB (0.42) ALDH1A1
SCHEMBL7625600 0.87 TDP1 (0.41) SCN1ASCN2ASCN3ATDP1KMT2A
SCHEMBL7624315 0.86 THRA (0.44) KMT2AMEN1ALDH1A1MAPT
SCHEMBL7629409 0.86 MCHR1 (0.43) SCN1ASCN2ASCN3AL3MBTL1LMNA
SCHEMBL7633349 0.86 CYP1A2 (0.35) TLR4KMT2ALMNASMN1; SMN2RAB9A

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed