SCHEMBL9709115

SCHEMBL9709115

CCN(c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1C(F)(F)F)C(Cl)c1ccccc1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL8018958 0.78 CYP3A4 (0.48) MAPTALDH1A1MAPK1LMNA
SCHEMBL9708979 0.76 MAPK1 (0.40) MAPTALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL9709186 0.74 ALDH3A1 (0.47) MAPTALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL9708914 0.70 MAPK1 (0.51) MAPTALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL9708920 0.69 MAPK1 (0.55) MAPTALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL28179841 0.63 TSHR (0.50) MAPTALDH1A1
SCHEMBL10862747 0.62 KMT2A (0.52) MAPTALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL9694041 0.59 TDP1 (0.47) MAPTALDH1A1MAPK1L3MBTL1
SCHEMBL9242110 0.59 ALDH1A1 (0.49) MAPTALDH1A1MAPK1L3MBTL1LMNA
Alcohol SCHEMBL10907169 0.59 TSHR (0.53) ALDH1A1L3MBTL1

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
EP-0498694-A1 Product for limiting the number of branches of vine and other ligneous plants and process for using the same C F P I (FR) 1992-08-12 EP claimed
EP-0497685-A1 Anti-bud product for vine and other ligneous plants and process for using the same C F P I (FR) 1992-08-05 EP claimed
EP-0498694-A1 Product for limiting the number of branches of vine and other ligneous plants and process for using the same C F P I (FR) 1992-08-12 EP disclosed
EP-0497685-A1 Anti-bud product for vine and other ligneous plants and process for using the same C F P I (FR) 1992-08-05 EP disclosed