SCHEMBL10656146

SCHEMBL10656146

CCCCCC(O)[C@H]1O[C@@](F)(n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 3/20 0.33
P2RY2 P41231 2/20 0.33
P2RY4 P51582 1/20 0.33
PNKP Q96T60 1/20 0.32
P2RY1 P47900 2/20 0.32
SLC28A1 O00337 1/20 0.32
SLC28A2 O43868 1/20 0.32
SLC29A1 Q99808 1/20 0.32
SLC28A3 Q9HAS3 1/20 0.32

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
SCHEMBL346518 0.75 CRBN (0.37) P2RY6P2RY2P2RY4SLC28A1SLC28A2
SCHEMBL5494548 0.74 PNKP (0.33) PNKP
SCHEMBL6520485 0.74 TYMP (0.32) P2RY6SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL5999884 0.73
Water SCHEMBL27625510 0.72 SLC28A1 (0.48) P2RY6P2RY2P2RY4SLC28A1SLC28A2
Hydrochloric Acid SCHEMBL10584588 0.72 SLC28A1 (0.48) P2RY6P2RY2P2RY4SLC28A1SLC28A2
SCHEMBL6517571 0.70 TUBB1 (0.32) P2RY6
SCHEMBL10718487 0.70 SLC28A1 (0.33) P2RY6P2RY2P2RY4SLC28A1SLC28A2
SCHEMBL7456552 0.69 SLC28A1 (0.39) P2RY2P2RY4SLC28A1SLC28A2SLC29A1
Phosphoric Acid SCHEMBL607047 0.69 SLC28A1 (0.45) P2RY6P2RY2P2RY4SLC28A1SLC28A2

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
JP-63196519-A None JP disclosed
JP-S63196519-A CARCINOSTATIC AGENT MITSUI TOATSU CHEM INC 1988-08-15 JP disclosed