SCHEMBL7510294

SCHEMBL7510294

CCC1(C)CC(OC(=O)c2ccccc2C(=O)OC2CC(C)(CC)N(O)C(C)(CC)C2C)C(C)C(C)(CC)N1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP2D6 P10635 1/20 0.42
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
BCHE P06276 5/20 0.37
TSHR P16473 3/20 0.36
CHRNB2 P17787 2/20 0.34
CHRNA4 P43681 2/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
HPGD P15428 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL11533230 0.89 GAA (0.44) BCHETSHRGAA
SCHEMBL4490161 0.87 MAPK1 (0.36) ALDH1A1TSHRGAAMAPK1
SCHEMBL6284323 0.81 CTSL (0.36) CYP3A4CYP2C9CYP2C19BCHE
SCHEMBL272632 0.80 CYP2D6 (0.32) CYP3A4CYP2C19CYP2D6
SCHEMBL272466 0.79 CHRM2 (0.35)
SCHEMBL11532289 0.77 CYP3A4 (0.31) CYP3A4CYP2C9CYP2C19TDP1CYP2D6
SCHEMBL5347678 0.77 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19TDP1CYP2D6
SCHEMBL11534823 0.77 GAA (0.44) TSHRGAA
SCHEMBL11533225 0.77 GAA (0.44) TSHRGAA
SCHEMBL11530462 0.76 CHRM1 (0.35) BCHE

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
US-5006577-A Durable, weatherproof CIBA-GEIGY CORPORATION (US) 1991-04-09 US claimed
EP-0309401-B2 Stabilization of coatings with N-hydroxy hindered amines CIBA SC HOLDING AG (CH) 2002-06-05 EP disclosed
EP-0309401-B1 Stabilization of coatings with N-hydroxy hindered amines CIBA GEIGY AG (CH) 1994-10-26 EP disclosed
US-5064883-A Stabilization of acid catalyzed thermoset resins with n-hydroxy hindered amines CIBA-GEIGY CORPORATION (US) 1991-11-12 US disclosed
US-5006577-A Durable, weatherproof CIBA-GEIGY CORPORATION (US) 1991-04-09 US disclosed
US-5004770-A Light, heat, and oxygen resistant CIBA-GEIGY CORPORATION (US) 1991-04-02 US disclosed
EP-0309401-A1 Stabilization of coatings with N-hydroxy hindered amines CIBA-GEIGY AG (CH) 1989-03-29 EP disclosed