SCHEMBL1300542

SCHEMBL1300542

CCOC(=O)C(N)CCCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 4/20 0.47
GABRP O00591 2/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRG2 P18507 2/20 0.47
GABRB3 P28472 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GABRE P78334 2/20 0.47
GABRA6 Q16445 2/20 0.47
GABRG1 Q8N1C3 2/20 0.47
GABRG3 Q99928 2/20 0.47
GABRQ Q9UN88 2/20 0.47
ALDH1A1 P00352 2/20 0.46
ENPEP Q07075 3/20 0.46
GRM8 O00222 1/20 0.42

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
SCHEMBL10682747 0.94 ALDH1A1 (0.53) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL7270344 0.93 ALDH1A1 (0.56) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL10681718 0.93 ALDH1A1 (0.56) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL7280935 0.93 ALDH1A1 (0.56) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL7286437 0.88 GABRP (0.56) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL374740 0.88 GABRP (0.56) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL4948196 0.88 GABRP (0.56) NOD1GABRPGABRDGABRA1GABRB1
Hydrochloric Acid SCHEMBL8758697 0.86 GABRP (0.54) NOD1GABRPGABRDGABRA1GABRB1
Hydrochloric Acid SCHEMBL8758700 0.86 GABRP (0.54) NOD1GABRPGABRDGABRA1GABRB1
SCHEMBL3955997 0.85 CYP1A2 (0.57) NOD1ALDH1A1CYP1A2TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9023636-B2 Microorganisms and methods for the biosynthesis of propylene GENOMATICA, INC. (US) 2015-05-05 US disclosed
US-8617862-B2 Microorganisms for producing propylene and methods related thereto GENOMATICA, INC. (US) 2013-12-31 US disclosed
EP-2563926-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF PROPYLENE Genomatica, Inc. (US) 2013-03-06 EP disclosed
US-20120329119-A1 MICROORGANISMS FOR PRODUCING PROPYLENE AND METHODS RELATED THERETO GENOMATICA, INC. 2012-12-27 US disclosed
WO-2011137198-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF PROPYLENE GENOMATICA, INC. (US) 2011-11-03 WO disclosed
US-20110269204-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF PROPYLENE AGAIN BIO APS (DK) 2011-11-03 US disclosed
US-4766110-A INHIBITS ANGIOTENSIN CONVERTING ENZYME, HYPOTENSIVE AGENTS RYAN JAMES W (US) 1988-08-23 US disclosed
EP-0073143-B1 NOVEL COMPLEX AMIDO AND IMIDO DERIVATIVES OF CARBOXYALKYL PEPTIDES AND THIOETHERS AND ETHERS OF PEPTIDES Ryan, James Walter (US) 1985-11-21 EP disclosed
US-4534799-A FATTY-/ACID MODIFIED ALKYL BENZENESULFONIC ACID AS LUBRICANT TECHNICAL PROCESSING, INC. (US) 1985-08-13 US disclosed
EP-0073143-A2 Novel complex amido and imido derivatives of carboxyalkyl peptides and thioethers and ethers of peptides Ryan, James Walter (US) 1983-03-02 EP disclosed