SCHEMBL10855395

SCHEMBL10855395

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

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.32
▸ MAPT P10636 3/20 0.32
▸ ALDH1A1 P00352 4/20 0.31
▸ HTT P42858 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ POLB P06746 2/20 0.31
▸ MITF O75030 1/20 0.31
▸ CCR6 P51684 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ MEN1 O00255 4/20 0.31
▸ KMT2A Q03164 4/20 0.31
▸ TTR P02766 2/20 0.31
▸ PPOX P50336 1/20 0.31
▸ THRB P10828 2/20 0.30
▸ THRA P10827 1/20 0.30
▸ ALB P02768 1/20 0.30
▸ PDE7A Q13946 1/20 0.30
▸ 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
SCHEMBL11288556 0.86 MAPT (0.34) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL11292229 0.85 ALDH1A1 (0.34) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL11295140 0.85 ALDH1A1 (0.33) TDP1MAPTALDH1A1HTTLMNA
Hydrochloric Acid SCHEMBL10854582 0.85 MAPT (0.33) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL11285449 0.84 MEN1 (0.35) TDP1MAPTALDH1A1LMNAPOLB
SCHEMBL11287905 0.81 ALDH1A1 (0.46) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL10947425 0.80 GPR35 (0.39) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL10766268 0.80 TDP1 (0.42) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL11291228 0.80 MEN1 (0.38) TDP1MAPTALDH1A1HTTLMNA
SCHEMBL11411623 0.79 MEN1 (0.38) TDP1MAPTALDH1A1HTTLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4563310-A HERBICIDES ZOECON CORPORATION (US) 1986-01-07 — — US disclosed
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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