SCHEMBL10852632

SCHEMBL10852632

COP(C)(=O)c1cc(Oc2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.60
▸ PDE7A Q13946 2/20 0.46
▸ TSHR P16473 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ S1PR4 O95977 1/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ TTR P02766 1/20 0.43
▸ PPOX P50336 1/20 0.43
▸ LMNA P02545 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MRGPRX4 Q96LA9 1/20 0.38

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
SCHEMBL10861112 0.87 TDP1 (0.61) TDP1PDE7ATSHRMAPK1S1PR4
SCHEMBL10856940 0.87 TDP1 (0.43) TDP1PDE7ATSHRMAPK1S1PR4
SCHEMBL10856547 0.86 TDP1 (0.61) TDP1MAPK1MEN1KMT2ATTR
SCHEMBL10860908 0.86 TDP1 (0.47) TDP1PDE7AMAPK1MEN1KMT2A
SCHEMBL10858848 0.86 TDP1 (0.43) TDP1PDE7ATSHRMAPK1S1PR4
SCHEMBL10854686 0.85 TDP1 (0.57) TDP1PDE7ATSHRMAPK1S1PR4
SCHEMBL11048611 0.83 TDP1 (0.56) TDP1PDE7ATSHRMAPK1S1PR4
SCHEMBL10857037 0.82 TDP1 (0.58) TDP1PDE7ATSHRMAPK1S1PR4
SCHEMBL10854190 0.81 MAPT (0.55) TDP1PDE7AMAPK1MEN1KMT2A
Chlomethoxyfen SCHEMBL38653 0.80 TDP1 (0.68) TDP1PDE7ATSHRMAPK1S1PR4

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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