SCHEMBL11293232

SCHEMBL11293232

CCP(=O)(OCC(=O)OC(C)C)c1cc(Oc2c(F)c(F)c(C)c(F)c2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.33
▸ HPGD P15428 3/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ PSMD14 O00487 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ GAA P10253 1/20 0.30

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
SCHEMBL11287898 0.91 TDP1 (0.33) ALDH1A1HPGDSMN1; SMN2LMNAMAPT
SCHEMBL11288520 0.89 — —
SCHEMBL11309195 0.88 MAPT (0.33) ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL11295052 0.81 — —
SCHEMBL11288556 0.81 MAPT (0.34) ALDH1A1HPGDSMN1; SMN2LMNAMAPT
Hydrochloric Acid SCHEMBL10854582 0.80 MAPT (0.33) ALDH1A1HPGDSMN1; SMN2LMNAMAPT
SCHEMBL10855395 0.79 TDP1 (0.32) ALDH1A1SMN1; SMN2LMNAMAPTMEN1
SCHEMBL10853165 0.78 MEN1 (0.54) ALDH1A1HPGDSMN1; SMN2LMNAMAPT
SCHEMBL11292229 0.77 ALDH1A1 (0.34) ALDH1A1HPGDSMN1; SMN2LMNAMAPT
SCHEMBL11295140 0.76 ALDH1A1 (0.33) ALDH1A1HPGDSMN1; SMN2LMNAMAPT

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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