SCHEMBL9870381

SCHEMBL9870381

CC(C)(C)c1cc(CCC(=O)Cl)cc(-n2nc3ccc(Cl)cc3n2)c1O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.39
MAOB P27338 3/20 0.38
MAOA P21397 2/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.36
ACHE P22303 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
AGTR1 P30556 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
KDM4E B2RXH2 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
SCHEMBL101259 0.92 MAOB (0.40) GAAMAOBMAOAKMT2AMEN1
SCHEMBL29365566 0.92 MAOB (0.40) GAAMAOBMAOAKMT2AMEN1
SCHEMBL13714982 0.92 GAA (0.39) GAAMAOBMAOAKMT2AMEN1
SCHEMBL30245015 0.90 GAA (0.38) GAAMAOBMAOAKMT2AMEN1
SCHEMBL9871207 0.89 MAOB (0.44) GAAMAOBMAOAKMT2AMEN1
SCHEMBL78795 0.89 GAA (0.42) GAAMAOBMAOAKMT2AMEN1
SCHEMBL29664175 0.89 GAA (0.42) GAAMAOBMAOAKMT2AMEN1
SCHEMBL13958162 0.89 GAA (0.37) GAAMAOBMAOAKMT2AMEN1
SCHEMBL9501153 0.88 GAA (0.58) GAAMAOBMAOAKMT2AMEN1
SCHEMBL1532655 0.88 GAA (0.38) GAAMAOBMAOAKMT2AMEN1

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 5 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
EP-0057160-B1 2-(2-HYDROXYPHENYL)-BENZOTRIAZOLES, THEIR USE AS ULTRAVIOLET STABILIZERS AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1985-06-19 EP disclosed
EP-0057160-A1 2-(2-Hydroxyphenyl)-benzotriazoles, their use as ultraviolet stabilizers and their preparation CIBA-GEIGY AG (CH) 1982-08-04 EP disclosed