SCHEMBL4461175

SCHEMBL4461175

CCCCOP(OCCCC)c1ccccc1CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.40
TSHR P16473 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38
LTA4H P09960 2/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL4452162 0.89 L3MBTL1 (0.38) L3MBTL1TSHRTDP1MAPTHPGD
SCHEMBL4456016 0.88 LIPG (0.39) L3MBTL1TSHRTDP1LTA4HCYP1A2
SCHEMBL4450146 0.88 LTA4H (0.37) L3MBTL1TSHRTDP1LTA4HCYP1A2
SCHEMBL4458079 0.81 MAPT (0.40) L3MBTL1TSHRMAPTHPGDATM
SCHEMBL4460496 0.81 LIPG (0.39) LTA4HCYP2C9CYP3A4
SCHEMBL4459685 0.80 LTA4H (0.39) L3MBTL1TSHRTDP1MAPTHPGD
SCHEMBL4454143 0.76 ADRA2B (0.33) L3MBTL1MAPTALDH1A1NPSR1MEN1
SCHEMBL4455991 0.75 LIPG (0.40) CYP2C9CYP3A4
SCHEMBL4460493 0.75 GABRA1 (0.38) L3MBTL1TSHRMAPTHPGDATM
SCHEMBL2938616 0.73 LTA4H (0.47) L3MBTL1TSHRTDP1HPGDLTA4H

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