SCHEMBL8091990

SCHEMBL8091990

COP(=O)(OCc1ccccc1O)OP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
TSHR P16473 4/20 0.41
HSPA5 P11021 1/20 0.36
AKR1B1 P15121 1/20 0.36
MPO P05164 1/20 0.35
GAA P10253 1/20 0.35
KEAP1 Q14145 1/20 0.34
CYP2D6 P10635 1/20 0.33
HIF1A Q16665 1/20 0.33
BTN3A1 O00481 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
SCHEMBL1178804 0.80 IDO1 (0.53) IDO1TSHRHSPA5AKR1B1GAA
SCHEMBL8091988 0.80 IDO1 (0.43) IDO1TSHRHSPA5AKR1B1GAA
SCHEMBL12732386 0.77 IDO1 (0.50) IDO1TSHRHSPA5AKR1B1GAA
SCHEMBL8090483 0.77 IDO1 (0.49) IDO1
Hydroquinone SCHEMBL8078917 0.77 IDO1 (0.45) IDO1MPO
SCHEMBL30705776 0.74 TSHR (0.55) IDO1TSHRAKR1B1MPOKEAP1
SCHEMBL21446960 0.74 TSHR (0.55) IDO1TSHRAKR1B1MPOKEAP1
SCHEMBL5322384 0.74 IDO1 (0.50) IDO1TSHRHSPA5AKR1B1GAA
Resorcinol SCHEMBL8090436 0.73 TTR (0.43) IDO1MPOGAA
SCHEMBL926056 0.72 IDO1 (0.52) IDO1TSHRHSPA5AKR1B1MPO

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-6140398-A Salicylic acid diphosphates for use as flame retardant materials RHODIA INC. (US) 2000-10-31 US disclosed