SCHEMBL10475397

SCHEMBL10475397

COC(=O)C(C)Oc1ccc(Oc2ncc(Cl)cc2[N+](=O)[O-])cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 3/20 0.42
TP53 P04637 2/20 0.42
MAPK1 P28482 2/20 0.42
MERTK Q12866 1/20 0.40
PTGER4 P35408 3/20 0.40
APEX1 P27695 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
NFKB1 P19838 1/20 0.40
HIF1A Q16665 1/20 0.40
GMNN O75496 1/20 0.40
PMP22 Q01453 1/20 0.40

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
SCHEMBL9175457 0.89 L3MBTL1 (0.49) MAPTL3MBTL1LMNASMN1; SMN2ALDH1A1
SCHEMBL30806281 0.87 ALDH1A1 (0.40) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL9450065 0.84 L3MBTL1 (0.71) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL11430304 0.83 MAPT (0.58) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL8683764 0.83 L3MBTL1 (0.58) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL10474178 0.82 L3MBTL1 (0.57) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL9215075 0.82 L3MBTL1 (0.57) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL10474119 0.82 L3MBTL1 (0.57) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL4913347 0.82 MAPT (0.56) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL11428913 0.81 MAPT (0.40) MAPTL3MBTL1MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0305593-A2 Intermediates for cyanamides of 2-pyridinyloxyphenoxypropionic acid CIBA-GEIGY AG (CH) 1989-03-08 EP claimed
US-4935051-A POSTEMERGENCE HERBICIDES CIBA-GEIGY CORPORATION (US) 1990-06-19 US disclosed
EP-0148119-B1 AMIDES OF 2-PHENOXYPROPIONIC ACID CIBA-GEIGY AG (CH) 1989-05-03 EP disclosed
EP-0305593-A2 Intermediates for cyanamides of 2-pyridinyloxyphenoxypropionic acid CIBA-GEIGY AG (CH) 1989-03-08 EP disclosed
US-4759796-A Used together with a carrier and other adjuvant CIBA-GEIGY CORPORATION (US) 1988-07-26 US disclosed
US-4640703-A CONTROLLING GRASSES IN CROPS CIBA-GEIGY CORPORATION (US) 1987-02-03 US disclosed
EP-0148119-A2 Amides of 2-phenoxypropionic acid CIBA-GEIGY AG (CH) 1985-07-10 EP disclosed