SCHEMBL9879512

SCHEMBL9879512

CCCCCCCCCCCCNC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
GAA P10253 4/20 0.55
MEN1 O00255 3/20 0.52
HPGD P15428 1/20 0.50
MAOB P27338 3/20 0.49
MAOA P21397 2/20 0.49
ACHE P22303 1/20 0.49
GSK3B P49841 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.40
AGTR1 P30556 1/20 0.40
HTT P42858 1/20 0.40
ENPP2 Q13822 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL7749752 1.00 KMT2A (0.55) KMT2AGAAMEN1HPGDMAOB
SCHEMBL14577851 0.92 GAA (0.49) KMT2AGAAMEN1HPGDMAOB
SCHEMBL14577858 0.92 GAA (0.49) KMT2AGAAMEN1HPGDMAOB
SCHEMBL9879519 0.90 KMT2A (0.53) KMT2AGAAMEN1HPGDMAOB
SCHEMBL14577850 0.90 GAA (0.51) KMT2AGAAMEN1HPGDMAOB
SCHEMBL9878606 0.90 GAA (0.51) KMT2AGAAMEN1HPGDMAOB
SCHEMBL8160946 0.88 KMT2A (0.55) KMT2AGAAMEN1HPGDMAOB
SCHEMBL9291159 0.88 GAA (0.47) KMT2AGAAMEN1HPGDMAOB
SCHEMBL14577846 0.88 GAA (0.54) KMT2AGAAMEN1HPGDMAOB
SCHEMBL14577857 0.88 KMT2A (0.51) KMT2AGAAMEN1HPGDMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5032498-A Soluble stabilizers CIBA-GEIGY CORPORATION (US) 1991-07-16 US disclosed
US-4973702-A AMIDES AND ESTERS, UV STABILIZERS FOR PLASTICS AND PHOTOGRAPHIC MATERIALS CIBA-GEIGY CORPORATION (US) 1990-11-27 US disclosed
US-4853471-A 2-(2-Hydroxyphenyl)-benztriazoles, their use as UV-absorbers and their preparation CIBA-GEIGY CORPORATION (US) 1989-08-01 US disclosed