SCHEMBL7124847

SCHEMBL7124847

O=P(O)(O)OCCOc1ccccc1.[KH]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.65
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
ALDH1A1 P00352 2/20 0.50
RECQL P46063 1/20 0.50
SRC P12931 1/20 0.50
KCNA3 P22001 1/20 0.50
PARP10 Q53GL7 1/20 0.49
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 1/20 0.46
FDPS P14324 2/20 0.45
TAAR1 Q96RJ0 1/20 0.45
TSHR P16473 1/20 0.45
ALOX15 P16050 1/20 0.44

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
SCHEMBL427191 0.98 PKM (0.67) PKMCYP2C9CYP2C19ALDH1A1RECQL
SCHEMBL1307122 0.93 PKM (0.61) PKMCYP2C9CYP2C19ALDH1A1RECQL
SCHEMBL15323698 0.88 INPPL1 (0.53) PKMCYP2C9CYP2C19PARP10MAPT
SCHEMBL22773976 0.87 KCNA3 (0.59) PKMCYP2C9CYP2C19ALDH1A1RECQL
SCHEMBL1309388 0.86 PKM (0.67) PKMCYP2C9CYP2C19ALDH1A1RECQL
Phosphoric Acid SCHEMBL22974795 0.85 PKM (0.65) PKMCYP2C9CYP2C19ALDH1A1RECQL
SCHEMBL28176043 0.84 PKM (0.59) PKMCYP2C9CYP2C19ALDH1A1RECQL
SCHEMBL22974794 0.84 PKM (0.59) PKMCYP2C9CYP2C19ALDH1A1RECQL
SCHEMBL16566552 0.82 INPPL1 (0.49) PKMCYP2C9CYP2C19PARP10MAPT
SCHEMBL10956697 0.82 PKM (0.71) PKMCYP2C9CYP2C19ALDH1A1RECQL

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-6670315-B1 Low pollution solvents and emulsions especially useful in cleaning soils from painted and unpainted metal and plastic surfaces HENKEL CORPORATION 2003-12-30 US claimed