Ethylene

Ethylene

SCHEMBL7414602

C=C.CCC(=O)Cc1c(C)cccc1N

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
ATP4A P20648 1/20 0.35
ATP4B P51164 1/20 0.35
TSHR P16473 1/20 0.34
PIK3CA P42336 1/20 0.34
CHEK1 O14757 1/20 0.34
SLC22A12 Q96S37 4/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL28474465 0.78 KDM4E (0.51) CD44ALDH1A1CYP3A4TDP1KDM4E
Ethylene SCHEMBL27537107 0.77 CD44 (0.48) CD44ALDH1A1HSD17B10CYP3A4TDP1
Ethylene SCHEMBL7412898 0.76 TDP1 (0.49) ALDH1A1HSD17B10TDP1L3MBTL1KDM4E
Ethylene SCHEMBL7409706 0.76 ALDH1A1 (0.34) ALDH1A1CYP3A4L3MBTL1KDM4E
SCHEMBL12214127 0.75 KDM4E (0.42) ALDH1A1HSD17B10KDM4EHPGDSLC22A12
SCHEMBL6344760 0.73 CD44 (0.52) CD44ALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL30417664 0.73 CD44 (0.52) CD44ALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL2009339 0.73 CD44 (0.52) CD44ALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL31606366 0.73 CD44 (0.52) CD44ALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL4830174 0.72 TDP1 (0.36) ALDH1A1HSD17B10CYP3A4TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640080-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS. SYNTEX INC (US) 1995-03-01 EP disclosed
US-5380739-A Angiotensin II antagonists SYNTEX (U.S.A.) INC. (US) 1995-01-10 US disclosed
WO-1993023391-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX (U.S.A.) INC. (US) 1993-11-25 WO disclosed
US-5212195-A Substituted indole antagonists derivatives which are angiotensin II SYNTEX (U.S.A.) INC. (US) 1993-05-18 US disclosed