SCHEMBL11208301

SCHEMBL11208301

CCOC(=O)COP(C)(=O)C(C)Oc1cc(Oc2c(F)c(F)c(C)c(F)c2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.33
▸ ALDH1A1 P00352 6/20 0.33
▸ LMNA P02545 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ NTSR1 P30989 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ USP10 Q14694 1/20 0.30
▸ PSMD14 O00487 1/20 0.30
▸ BLM P54132 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
SCHEMBL11202097 0.91 MAPT (0.34) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL11200433 0.85 MAPT (0.35) MAPTALDH1A1LMNACYP3A4MAPK1
SCHEMBL11199866 0.83 MAPT (0.33) MAPTALDH1A1LMNAHPGDCYP1A2
SCHEMBL11199382 0.83 MAPT (0.34) MAPTALDH1A1LMNA
SCHEMBL10944300 0.80 MEN1 (0.52) MAPTALDH1A1LMNACYP1A2CYP2C19
SCHEMBL9860998 0.79 RAB9A (0.33) MAPTALDH1A1LMNAHPGDMEN1
SCHEMBL10877259 0.78 ALDH1A1 (0.42) MAPTALDH1A1LMNAHPGDNPSR1
SCHEMBL11204589 0.77 MAPT (0.35) MAPTALDH1A1LMNAHPGDMEN1
SCHEMBL11205867 0.76 ALDH1A1 (0.34) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL11293232 0.76 ALDH1A1 (0.33) MAPTALDH1A1LMNAHPGDMEN1

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-0078536-A2 Phosphinates and phosphonates and their use in the control of weeds SANDOZ AG (CH) 1983-05-11 — — EP disclosed
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