SCHEMBL11533870

SCHEMBL11533870

CCC1(C)CC(OC(=O)Nc2ccc(C)c(NC(=O)OC3CC(C)(CC)NC(C)(CC)C3C)c2)C(C)C(C)(CC)N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
NLRP3 Q96P20 1/20 0.36
NPC1 O15118 5/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
HTT P42858 2/20 0.32
RAB9A P51151 5/20 0.32
CYP2C9 P11712 3/20 0.32
CYP2C19 P33261 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CYP1A2 P05177 2/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
MAPT P10636 1/20 0.32
P2RX7 Q99572 1/20 0.32
MAPK14 Q16539 1/20 0.32

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
SCHEMBL11531447 0.87 ALDH1A1 (0.48) ALDH1A1LMNAMAPK1NPC1L3MBTL1
SCHEMBL11535548 0.85 SMN1; SMN2 (0.38) ALDH1A1LMNANPC1L3MBTL1HTT
SCHEMBL11535816 0.81 ALDH1A1 (0.38) ALDH1A1LMNAMAPK1L3MBTL1HPGD
SCHEMBL11451891 0.79 MEN1 (0.38) ALDH1A1LMNAMAPK1NPC1HTT
SCHEMBL11531570 0.75 CHRM1 (0.33)
SCHEMBL11533329 0.75
SCHEMBL11532410 0.74 EPHX1 (0.38) ALDH1A1MEN1KMT2A
SCHEMBL4449683 0.74 GAA (0.45) ALDH1A1LMNAMAPK1NLRP3NPC1
SCHEMBL29549914 0.74 GAA (0.45) ALDH1A1LMNAMAPK1NLRP3NPC1
SCHEMBL11536762 0.73 GAA (0.41) ALDH1A1MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4141883-A Stabilization of synthetic polymers by penta-or-hexa-substituted 4-piperidinol derivatives SANKYO COMPANY, LIMITED (JP) 1979-02-27 US disclosed
US-4075165-A 2,2,6,6-TETRA-SUBSTITUTED-4-PIPERIDINOL CIBA-GEIGY CORPORATION (US) 1978-02-21 US disclosed