SCHEMBL10858848

SCHEMBL10858848

COP(C)(=O)c1cc(Oc2c(Cl)cc(Cl)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.43
▸ MAPK1 P28482 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ MAPT P10636 3/20 0.38
▸ POLB P06746 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ HTT P42858 1/20 0.38
▸ MERTK Q12866 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ RAF1 P04049 1/20 0.36
▸ GFER P55789 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ PDE7A Q13946 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ TTR P02766 1/20 0.33
▸ PPOX P50336 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33

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
SCHEMBL10858278 0.88 TDP1 (0.45) TDP1TSHRMAPTPOLBALDH1A1
SCHEMBL10856940 0.86 TDP1 (0.43) TDP1MAPK1TSHRMAPTALDH1A1
SCHEMBL10852632 0.86 TDP1 (0.60) TDP1MAPK1TSHRMAPTALDH1A1
SCHEMBL11044970 0.81 TDP1 (0.42) TDP1MAPK1TSHRMAPTPOLB
SCHEMBL11292229 0.80 ALDH1A1 (0.34) TDP1MAPK1MAPTPOLBALDH1A1
SCHEMBL10854101 0.79 TSHR (0.51) TDP1MAPK1TSHRMAPTPOLB
SCHEMBL11152258 0.79 TSHR (0.61) TDP1MAPK1TSHRMAPTPOLB
SCHEMBL11781925 0.78 TDP1 (0.50) TDP1MAPK1TSHRMAPTPOLB
SCHEMBL11155633 0.78 TSHR (0.47) TDP1MAPK1TSHRMAPTPOLB
SCHEMBL10884723 0.78 TDP1 (0.41) TDP1MAPK1TSHRMAPTPOLB

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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