SCHEMBL4448699

SCHEMBL4448699

Cc1cccc(OP(=O)(Oc2cccc(C)c2C)c2ccccc2)c1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.61
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 3/20 0.43
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
POLB P06746 3/20 0.42
ALDH1A1 P00352 3/20 0.42
CRHBP P24387 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
CRHR2 Q13324 1/20 0.42
CYP1A2 P05177 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP3A4 P08684 2/20 0.40
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA4 P22748 3/20 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
SCHEMBL779114 0.87 L3MBTL1 (0.55) MAPTTDP1L3MBTL1HTTPOLB
SCHEMBL30500647 0.87 L3MBTL1 (0.55) MAPTTDP1L3MBTL1HTTPOLB
SCHEMBL17491631 0.86 MAPT (0.61) MAPTTDP1L3MBTL1GAAHTT
SCHEMBL4136181 0.83 MAPT (0.57) MAPTTDP1GAAHTTLMNA
SCHEMBL4451476 0.82 MAPT (0.61) MAPTTDP1L3MBTL1GAAHTT
SCHEMBL28173299 0.81 L3MBTL1 (0.69) MAPTTDP1L3MBTL1HTTLMNA
SCHEMBL12737774 0.79 L3MBTL1 (0.55) MAPTTDP1L3MBTL1GAALMNA
SCHEMBL108985 0.79 MAPT (0.71) MAPTTDP1L3MBTL1GAAHTT
SCHEMBL6814025 0.78 MAPT (0.65) MAPTGAAHTTLMNAMAPK1
SCHEMBL989873 0.77 MAPT (0.59) MAPTTDP1L3MBTL1GAAHTT

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