SCHEMBL10950818

SCHEMBL10950818

COP(=O)(COc1cc(Oc2ccc(Cl)cc2)ccc1[N+](=O)[O-])OC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.45
▸ PDE7A Q13946 1/20 0.44
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ LMNA P02545 4/20 0.43
▸ HPGD P15428 3/20 0.43
▸ MAPT P10636 6/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ MERTK Q12866 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTT P42858 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ ALPG P10696 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL10947981 0.91 PDE7A (0.54) TDP1PDE7ASMN1; SMN2LMNAHPGD
SCHEMBL10951063 0.90 TDP1 (0.58) TDP1PDE7ASMN1; SMN2LMNAHPGD
SCHEMBL10949311 0.88 TDP1 (0.46) TDP1PDE7ASMN1; SMN2LMNAHPGD
SCHEMBL10950259 0.85 MEN1 (0.43) TDP1SMN1; SMN2LMNAHPGDMAPT
SCHEMBL10948472 0.81 MEN1 (0.59) TDP1SMN1; SMN2LMNAHPGDMAPT
SCHEMBL10948307 0.81 MEN1 (0.47) TDP1SMN1; SMN2LMNAHPGDMAPT
SCHEMBL7937740 0.81 TDP1 (0.50) TDP1PDE7ASMN1; SMN2LMNAHPGD
SCHEMBL10952430 0.79 LMNA (0.52) TDP1SMN1; SMN2LMNAHPGDMAPT
SCHEMBL11149455 0.75 TDP1 (0.60) TDP1PDE7ASMN1; SMN2LMNAHPGD
SCHEMBL10856940 0.75 TDP1 (0.43) TDP1PDE7ASMN1; SMN2LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4556520-A HERBICIDES, INSECTICIDES ZOECON CORPORATION (US) 1985-12-03 — — US disclosed
US-4536355-A Phenoxyphenylaminoalkylphosphinates useful in weed control ZOECON CORPORATION (US) 1985-08-20 — — US disclosed
US-4456464-A Phenoxy- and pyridyloxy-phenoxyalkyl phosphinates and related sulfur compounds for weed control ZOECON CORPORATION (US) 1984-06-26 — — US disclosed
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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