Ethylene

Ethylene

SCHEMBL7412898

C=C.CCC(=O)Cc1c(C)cccc1[N+](=O)[O-]

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
TSHR P16473 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HSD17B10 Q99714 1/20 0.46
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
GPR35 Q9HC97 1/20 0.40
KCNMA1 Q12791 1/20 0.39
FBP1 P09467 1/20 0.39
LMNA P02545 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
SCHEMBL7409151 0.83 TDP1 (0.47) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL16397415 0.83 TDP1 (0.60) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL4408694 0.83 TDP1 (0.60) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL7877955 0.80 TDP1 (0.57) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL31377046 0.80 TDP1 (0.53) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL31016530 0.78 L3MBTL1 (0.48) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL13930332 0.78 L3MBTL1 (0.48) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
SCHEMBL13236484 0.77 TSHR (0.60) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10
Ethylene SCHEMBL7415017 0.77 TDP1 (0.39) TDP1L3MBTL1TSHRSMN1; SMN2KMT2A
SCHEMBL31016532 0.77 L3MBTL1 (0.49) TDP1L3MBTL1TSHRSMN1; SMN2HSD17B10

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