Ethylene

Ethylene

SCHEMBL7400535

C=C.O=Cc1cc([N+](=O)[O-])ccc1F

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.59
ALDH1A1 P00352 5/20 0.55
HIF1A Q16665 1/20 0.55
PTPN1 P18031 1/20 0.44
PLG P00747 1/20 0.41
LMNA P02545 3/20 0.41
TSHR P16473 2/20 0.41
MAPT P10636 2/20 0.40
NTSR1 P30989 1/20 0.40
TDP1 Q9NUW8 3/20 0.40
HSD17B10 Q99714 1/20 0.40
TXNRD1 Q16881 1/20 0.40
TXNRD3 Q86VQ6 1/20 0.40
TXNRD2 Q9NNW7 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTPRC P08575 1/20 0.39
S100A4 P26447 1/20 0.39

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
SCHEMBL349039 0.96 ERN1 (0.62) ERN1ALDH1A1HIF1APTPN1PLG
SCHEMBL4647893 0.84 ALDH1A1 (0.56) ERN1ALDH1A1HIF1APLGLMNA
SCHEMBL30648783 0.84 ALDH1A1 (0.56) ERN1ALDH1A1HIF1APLGLMNA
SCHEMBL1591294 0.81 ERN1 (0.58) ERN1ALDH1A1HIF1APTPN1LMNA
SCHEMBL8098203 0.81 ALDH1A1 (0.53) ERN1ALDH1A1HIF1APLGLMNA
SCHEMBL28750322 0.80 ALDH1A1 (0.56) ERN1ALDH1A1HIF1APLGLMNA
SCHEMBL16951459 0.80 ALDH1A1 (0.56) ERN1ALDH1A1HIF1APLGLMNA
SCHEMBL27720125 0.79 HSPB1 (0.58) ERN1ALDH1A1HIF1AMAPTMEN1
SCHEMBL2652355 0.79 ERN1 (0.69) ERN1ALDH1A1PTPN1LMNATSHR
Ethylene SCHEMBL28992810 0.79 ERN1 (0.93) ERN1ALDH1A1LMNATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0593603-B1 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-11-20 EP disclosed
US-6127359-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-10-03 US disclosed
US-5939412-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-08-17 US disclosed
US-5693636-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 1997-12-02 US disclosed
EP-0593603-A1 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1994-04-27 EP disclosed
WO-1993000095-A2 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1993-01-07 WO disclosed