SCHEMBL10947347

SCHEMBL10947347

COP(=O)(CSc1cc(Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1[N+](=O)[O-])OC

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.47
▸ MAPT P10636 5/20 0.43
▸ LMNA P02545 5/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ HPGD P15428 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ HTT P42858 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ S1PR4 O95977 1/20 0.38
▸ NPSR1 Q6W5P4 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
SCHEMBL10958023 0.93 TDP1 (0.56) PDE7ATDP1MAPTLMNASMN1; SMN2
SCHEMBL10948522 0.83 MEN1 (0.58) TDP1MAPTLMNASMN1; SMN2HPGD
SCHEMBL10947981 0.80 PDE7A (0.54) PDE7ATDP1MAPTLMNASMN1; SMN2
SCHEMBL10951733 0.79 MEN1 (0.45) TDP1MAPTLMNASMN1; SMN2HPGD
SCHEMBL10951558 0.79 MEN1 (0.41) TDP1MAPTLMNASMN1; SMN2HPGD
SCHEMBL10943962 0.76 PDE7A (0.71) PDE7ATDP1MAPTLMNASMN1; SMN2
SCHEMBL10947869 0.75 MEN1 (0.56) TDP1MAPTLMNASMN1; SMN2HPGD
SCHEMBL10880938 0.74 PDE7A (0.50) PDE7ATDP1MAPTLMNASMN1; SMN2
SCHEMBL2961786 0.74 PDE7A (0.74) PDE7ATDP1MAPTLMNASMN1; SMN2
SCHEMBL10946835 0.74 MEN1 (0.56) TDP1MAPTLMNASMN1; SMN2HPGD

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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