SCHEMBL11285449

SCHEMBL11285449

Cc1c(F)c(F)c(Oc2ccc([N+](=O)[O-])c(P(=O)(O)c3ccccc3)c2)c(Cl)c1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ TTR P02766 2/20 0.35
▸ ALB P02768 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ POLB P06746 3/20 0.32
▸ MAPT P10636 3/20 0.32
▸ WDR5 P61964 2/20 0.32
▸ PPOX P50336 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ CRHBP P24387 1/20 0.31
▸ CRHR2 Q13324 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ PIN1 Q13526 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL11291228 0.84 MEN1 (0.38) MEN1KMT2ATDP1TTRALB
SCHEMBL10855395 0.84 TDP1 (0.32) MEN1KMT2ATDP1TTRALB
SCHEMBL11288556 0.84 MAPT (0.34) MEN1KMT2ATDP1TTRPOLB
SCHEMBL11295140 0.83 ALDH1A1 (0.33) MEN1KMT2ATDP1TTRALB
Hydrochloric Acid SCHEMBL10854582 0.83 MAPT (0.33) MEN1KMT2ATDP1TTRPOLB
SCHEMBL11292229 0.82 ALDH1A1 (0.34) MEN1KMT2ATDP1TTRALB
SCHEMBL11287905 0.80 ALDH1A1 (0.46) MEN1KMT2ATDP1TTRALB
SCHEMBL10947425 0.79 GPR35 (0.39) MEN1KMT2ATDP1TTRALB
SCHEMBL10766268 0.79 TDP1 (0.42) MEN1KMT2ATDP1TTRALB
SCHEMBL9120594 0.78 MEN1 (0.52) MEN1KMT2ATDP1TTRALB

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
EP-0065374-A1 Substituted phosphinates and phosphinothioates and their use for the control of weeds ZOECON CORPORATION (US) 1982-11-24 — — EP disclosed
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