SCHEMBL4564484

SCHEMBL4564484

O=P(CCCO)(CCCO)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
BTN3A1 O00481 3/20 0.41
ALDH1A1 P00352 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
ANPEP P15144 1/20 0.40
LAP3 P28838 1/20 0.40

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
SCHEMBL4564647 0.94 SRC (0.48) SRCL3MBTL1TDP1GAACYP2C9
SCHEMBL4458081 0.85 SRC (0.50) SRCL3MBTL1TDP1GAACYP2C9
SCHEMBL4563939 0.81 CYP3A4 (0.52) L3MBTL1GAAMEN1KMT2A
SCHEMBL777540 0.81 L3MBTL1 (0.50) SRCL3MBTL1TDP1
SCHEMBL4453721 0.79 SRC (0.48) SRCL3MBTL1TDP1GAACYP2C9
SCHEMBL3229927 0.79 CETP (0.49) L3MBTL1
SCHEMBL4564589 0.79 SMN1; SMN2 (0.56) SRCCYP2C19ALDH1A1
SCHEMBL5488555 0.78 L3MBTL1 (0.47) SRCL3MBTL1TDP1
SCHEMBL9557354 0.78 CETP (0.51) L3MBTL1
SCHEMBL4564600 0.77 TSHR (0.50) L3MBTL1GAAMEN1KMT2A

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