SCHEMBL4452162

SCHEMBL4452162

CCCOP(OCCC)c1ccccc1CC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
ATM Q13315 2/20 0.33
HPGD P15428 1/20 0.33
MGLL Q99685 1/20 0.32
NR1I2 O75469 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL4461175 0.89 L3MBTL1 (0.40) L3MBTL1MAPTNPSR1ALDH1A1LMNA
SCHEMBL4454143 0.87 ADRA2B (0.33) L3MBTL1MAPTNPSR1ALDH1A1LMNA
SCHEMBL4458079 0.84 MAPT (0.40) L3MBTL1MAPTNPSR1GABRA1GABRB2
SCHEMBL4460496 0.84 LIPG (0.39) CYP4F2CYP4A11
SCHEMBL4462349 0.78 TSHR (0.35) L3MBTL1MAPTNPSR1ALDH1A1LMNA
SCHEMBL4460493 0.78 GABRA1 (0.38) L3MBTL1MAPTNPSR1ALDH1A1KMT2A
SCHEMBL4450146 0.77 LTA4H (0.37) L3MBTL1ALDH1A1MEN1KMT2ATSHR
SCHEMBL4456016 0.77 LIPG (0.39) L3MBTL1ALDH1A1TSHRTDP1
SCHEMBL1726433 0.73 GABRA1 (0.34) L3MBTL1MAPTNPSR1KMT2AGABRA1
SCHEMBL4455343 0.73 CYP4F2 (0.34) L3MBTL1MAPTNPSR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed