Ethane

Ethane

SCHEMBL27359121

CC.CCOCN(C(=O)CCl)c1ccccc1CN

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
TP53 P04637 6/20 0.59
TDP1 Q9NUW8 3/20 0.59
CYP3A4 P08684 1/20 0.59
KMT2A Q03164 5/20 0.51
MEN1 O00255 3/20 0.51
NR1I2 O75469 1/20 0.46
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
PAX8 Q06710 3/20 0.38
JAK2 O60674 2/20 0.38
POLB P06746 2/20 0.36
HTT P42858 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
RNF4 P78317 1/20 0.34
LMNA P02545 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
SCHEMBL9863632 0.90 ALDH1A1 (0.66) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL4339458 0.85 TP53 (0.60) ALDH1A1TP53TDP1CYP3A4KMT2A
Ethane SCHEMBL27742376 0.84 TP53 (0.45) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL27319258 0.84 TP53 (0.74) ALDH1A1TP53TDP1CYP3A4KMT2A
Ethane SCHEMBL6053657 0.82 ALDH1A1 (0.63) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL9614304 0.80 ALDH1A1 (0.64) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL27352642 0.80 TP53 (0.64) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL9420240 0.79 TP53 (0.84) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL8378909 0.78 TDP1 (0.76) ALDH1A1TP53TDP1CYP3A4KMT2A
SCHEMBL31199167 0.78 TP53 (0.50) ALDH1A1TP53TDP1CYP3A4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105142402-B Use penoxsuam and the collaboration control of weeds of Acetochlor 美国陶氏益农公司 2018-05-01 CN disclosed
CN-101584333-A Herbicides with acylated aminophenylsulfonyl urea BAYER CROPSCIENCE GMBH (DE) 2009-11-25 CN disclosed
CN-100337544-C Herbicidal compositions with acylated aminophenylsulfonylureas BAYER CROPSCIENCE GMBH (DE) 2007-09-19 CN disclosed
CN-1220438-C Herbicidal composition for tolerant or resistant rice crops AVENTIS CROP SCIENCE GMBH (DE) 2005-09-28 CN disclosed
CN-1642427-A Herbicide combination with acylated aminophenylsulfonylureas BAYER CROPSCIENCE GMBH (DE) 2005-07-20 CN disclosed
CN-1073798-C Synergistic herbicidal composition and method of use thereof ZENECA LTD (GB) 2001-10-31 CN disclosed
CN-1300184-A Concentrate herbicidal composition MONSANTO CO (US) 2001-06-20 CN disclosed
CN-1190867-A Synergistic herbicidal composition and method of use thereof ZENECA LTD (GB) 1998-08-19 CN disclosed
CN-1064387-A The weed killer herbicide of citrus, sugarcane, oil palm etc. DU PONT (US) 1992-09-16 CN disclosed