Ethylene

Ethylene

SCHEMBL7413101

C=C.CCC(=O)Cc1ccc(F)cc1[N+](=O)[O-]

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
MAPT P10636 5/20 0.43
TDP1 Q9NUW8 4/20 0.42
ATM Q13315 1/20 0.42
PDK1 Q15118 1/20 0.42
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPK1 P28482 2/20 0.38
LMNA P02545 1/20 0.38
KCNMA1 Q12791 1/20 0.38

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
SCHEMBL2568261 0.97 CYP1A2 (0.48) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL7410546 0.83 TDP1 (0.45) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL2994232 0.82 CYP1A2 (0.50) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL30410464 0.82 CYP1A2 (0.50) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL19329660 0.81 CYP1A2 (0.69) CYP1A2MAPTTDP1PDK1ALDH1A1
SCHEMBL6973093 0.81 CYP1A2 (0.49) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL2989578 0.80 CYP1A2 (0.69) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL27707665 0.80 TDP1 (0.49) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL2989584 0.80 CYP1A2 (0.69) CYP1A2MAPTTDP1ATMPDK1
SCHEMBL7594106 0.79 CYP1A2 (0.50) CYP1A2MAPTTDP1ATMPDK1

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