Ethylene

Ethylene

SCHEMBL3947796

C=C.C=C.C=C.CC(C)(C)c1cc(CC(=O)O)cc(C(C)(C)C)c1O.CC(C)(C)c1cc(CC(=O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
GAA P10253 6/20 0.50
KMT2A Q03164 4/20 0.50
TSHR P16473 3/20 0.50
MEN1 O00255 3/20 0.50
MAPK1 P28482 3/20 0.50
LMNA P02545 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
BLM P54132 2/20 0.50
ATM Q13315 2/20 0.50
HIF1A Q16665 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
MAPT P10636 2/20 0.50
USP2 O75604 1/20 0.50
CYP2D6 P10635 1/20 0.50
GPR55 Q9Y2T6 1/20 0.49
GMNN O75496 1/20 0.49
GABBR2 O75899 1/20 0.49
TP53 P04637 1/20 0.49

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
Ethylene SCHEMBL3949822 1.00 ALDH1A1 (0.50) ALDH1A1GAAKMT2ATSHRMEN1
SCHEMBL38555 0.96 ALDH1A1 (0.53) ALDH1A1GAAKMT2ATSHRMEN1
Ammonia Solution, Strong SCHEMBL3948778 0.94 ALDH1A1 (0.52) ALDH1A1GAAKMT2ATSHRMEN1
Ethylene Glycol SCHEMBL206250 0.91 ALDH1A1 (0.51) ALDH1A1GAAKMT2ATSHRMEN1
SCHEMBL27913587 0.88 ALDH1A1 (0.46) ALDH1A1GAAKMT2ATSHRMEN1
SCHEMBL3956058 0.88 ALDH1A1 (0.53) ALDH1A1GAAKMT2ATSHRMEN1
SCHEMBL3949798 0.87 GAA (0.47) ALDH1A1GAAKMT2ATSHRMEN1
SCHEMBL7786499 0.86 ALDH1A1 (0.45) ALDH1A1GAAKMT2ATSHRMEN1
Octane SCHEMBL28875045 0.86 THRA (0.49) ALDH1A1GAAKMT2ATSHRMEN1
SCHEMBL283522 0.86 CYP1A2 (0.52) ALDH1A1GAAKMT2ATSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035470-A1 THERMOPLASTIC RESIN COMPOSITIONS SUITABLE FOR USE IN TRANSPARENT LAMINATES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-03-18 EP disclosed
WO-2007149082-A1 THERMOPLASTIC RESIN COMPOSITIONS SUITABLE FOR USE IN TRANSPARENT LAMINATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-12-27 WO disclosed
US-20070289693-A1 Thermoplastic resin compositions suitable for use in transparent laminates E. I. DU PONT DE NEMOURS AND COMPANY 2007-12-20 US disclosed