SCHEMBL10941109

SCHEMBL10941109

CC(C)CCCCCCCOP(OCCCCCCCC(C)C)Oc1ccccc1.OP(O)O.OP(O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.40
HPGD P15428 1/20 0.38
KCNA3 P22001 2/20 0.35
NR1H4 Q96RI1 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
PPIA P62937 1/20 0.33
LMNA P02545 1/20 0.33
GPR88 Q9GZN0 1/20 0.33
MMP9 P14780 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL8633132 0.97 RARB (0.40) RARBHPGDKCNA3NR1H4HDAC3
SCHEMBL10946154 0.97 RARB (0.40) RARBHPGDKCNA3NR1H4HDAC3
SCHEMBL17433581 0.95 RARB (0.39) RARBHPGDKCNA3HDAC3HDAC4
SCHEMBL1100667 0.95 RARB (0.39) RARBHPGDKCNA3HDAC3HDAC4
SCHEMBL108804 0.95 RARB (0.39) RARBHPGDKCNA3HDAC3HDAC4
SCHEMBL11606938 0.94 RARB (0.38) RARBHPGDKCNA3NR1H4HDAC3
Hydrochloric Acid SCHEMBL9008281 0.93 RARB (0.38) RARBHPGDKCNA3HDAC3HDAC4
SCHEMBL78491 0.92 RARB (0.39) RARBHPGDKCNA3HDAC3HDAC4
SCHEMBL7621620 0.92 RARB (0.39) RARBHPGDKCNA3HDAC3HDAC4
SCHEMBL263013 0.92 RARB (0.39) RARBHPGDKCNA3HDAC3HDAC4

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-4557850-A FLUORINATED HYDROCARBON, AMIDE ABSORBENT, AND PHOSPHITE STABILIZER MATSUSHITA ELECTRIC INDUSTRIAL COMPANY, LIMITED (JP) 1985-12-10 US disclosed