Etocrylene

Etocrylene

SCHEMBL7199053

CC(C)CCCCCOC(=O)C(C#N)=C(c1ccccc1)c1ccccc1.CCOC(=O)C(C#N)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
LMNA P02545 3/20 0.56
MAPK1 P28482 1/20 0.56
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 5/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
USP2 O75604 1/20 0.38
CRHBP P24387 1/20 0.38
RAB9A P51151 1/20 0.38
CRHR2 Q13324 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
RARB P10826 1/20 0.38
CYP19A1 P11511 2/20 0.37
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
HIF1A Q16665 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL9654433 0.95 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1MAPTRAB9A
SCHEMBL78385 0.95 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1MAPTRAB9A
SCHEMBL2158058 0.86 LMNA (0.61) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2
SCHEMBL15797630 0.85 LMNA (0.57) ALDH1A1LMNAMAPK1MAPTRAB9A
SCHEMBL31339448 0.85 LMNA (0.46) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2
SCHEMBL1123572 0.84 ALDH1A1 (0.65) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2
SCHEMBL5331475 0.84 ALDH1A1 (0.65) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2
SCHEMBL14877495 0.84 ALDH1A1 (0.65) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2
SCHEMBL7205837 0.84 ALDH1A1 (0.65) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2
Etocrylene SCHEMBL1768864 0.84 ALDH1A1 (0.62) ALDH1A1LMNAMAPK1MAPTSMN1; SMN2

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-6596461-B1 Useful for stabilizing an organic material against degradation induced by light, heat or oxidation CIBA SPECIALTY CHEMICALS CORPORATION 2003-07-22 US disclosed
US-5376710-A Light, oxygen, heat resistance CIBA-GEIGY CORPORATION (US) 1994-12-27 US disclosed