SCHEMBL9694698

SCHEMBL9694698

COc1ccc(C(OC[C@H]2OCC[C@@H]2O[PH](=O)O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A11 P48066 7/20 0.41
SLC6A1 P30531 3/20 0.41
TYMP P19971 1/20 0.40
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
SLC6A12 P48065 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
SLC6A13 Q9NSD5 1/20 0.37
NPY2R P49146 1/20 0.35
CYP2J2 P51589 1/20 0.34
KIF11 P52732 1/20 0.33

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
SCHEMBL298850 0.86 SLC6A11 (0.41) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL14062474 0.82 TYMP (0.41) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL14062475 0.82 TYMP (0.41) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL14029738 0.82 TYMP (0.41) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL23215181 0.81 TYMP (0.44) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL283757 0.81 TYMP (0.44) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL13690826 0.81 TYMP (0.44) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL25797601 0.77 TYMP (0.38) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL9692839 0.77 SLC6A11 (0.47) SLC6A11SLC6A1TYMPMEN1KMT2A
SCHEMBL25797603 0.76 SLC6A11 (0.35) SLC6A11SLC6A1TYMPMEN1KMT2A

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-5169842-A OLIGOPHOSPHATES WITH AN ANTIVIRAL ACTION BAYER AKTIENGESELLSCHAFT (DE) 1992-12-08 US disclosed