SCHEMBL4091179

SCHEMBL4091179

Cc1ccc([CH]CCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 4/20 0.50
LMNA P02545 3/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP2A6 P11509 1/20 0.41
HTT P42858 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL5058134 0.90 CYP2A6 (0.48) GPR52MAPTTDP1CYP2A6NPC1
SCHEMBL1115608 0.85 MAOB (0.46) GPR52TDP1CYP2A6SMN1; SMN2
SCHEMBL1987774 0.83 MAOB (0.46) LMNAMAPTNPSR1TDP1L3MBTL1
SCHEMBL8709601 0.82 GPR52 (0.49) GPR52TDP1CYP2A6SMN1; SMN2
SCHEMBL31197196 0.81 GPR52 (0.55) GPR52LMNAMAPTTDP1L3MBTL1
SCHEMBL3822095 0.81 GPR52 (0.51) GPR52MAPTTDP1NPC1RAB9A
SCHEMBL1355705 0.80 TAAR1 (0.56) MAPT
SCHEMBL7814468 0.80 NFE2L2 (0.48) GPR52LMNAMAPTL3MBTL1NPC1
SCHEMBL5632468 0.79 GPR52 (0.54) GPR52LMNATDP1L3MBTL1CYP2A6
SCHEMBL4608345 0.79 GRIN2D (0.43) LMNACYP2A6KDM4ESMN1; SMN2

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-7482410-B2 Processes for producing high density polyethylene EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-01-27 US disclosed