SCHEMBL7640430

SCHEMBL7640430

CCCCC(CC)CP(=O)([O-])[O-].CCCCC(CC)CP(=O)([O-])[O-].CCCCC(CC)CP(=O)([O-])[O-].[Cr+3].[Cr+3]

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CA2 P00918 5/20 0.46
ALDH1A1 P00352 5/20 0.45
TDP1 Q9NUW8 2/20 0.45
TSHR P16473 4/20 0.43
ATM Q13315 1/20 0.42
FDPS P14324 1/20 0.39
GGPS1 O95749 2/20 0.36
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 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
SCHEMBL7866460 0.96 ALDH1A1 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL152404 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL29702438 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL640362 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL673441 0.88 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL18148994 0.83 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL18148977 0.83 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL3967221 0.83 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL674510 0.83 CYP3A4 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1
SCHEMBL674508 0.83 ALDH1A1 (0.50) CYP3A4L3MBTL1CA2ALDH1A1TDP1

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-6465585-B2 REACTION PRODUCT OF A CHROMIUM CONTAINING COMPOUND, AN ORGANOMAGNESIUM COMPOUND AND A SILYL PHOSPHONATE BRIDGESTONE CORPORATION (JP) 2002-10-15 US disclosed