SCHEMBL6672166

SCHEMBL6672166

C=CC(O)CNCCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
ALDH1A1 P00352 3/20 0.37
ANPEP P15144 1/20 0.37
ERAP2 Q6P179 1/20 0.37
ADH1B P00325 2/20 0.37
ADH1C P00326 2/20 0.37
ADH1A P07327 2/20 0.37
ADH7 P40394 2/20 0.37
PKM P14618 1/20 0.33
TRPA1 O75762 1/20 0.33
DDAH1 O94760 1/20 0.33
GAPDH P04406 1/20 0.33
MAPT P10636 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
FAAH O00519 2/20 0.32
EPHX1 P07099 1/20 0.31
ADH4 P08319 1/20 0.31
PTGS1 P23219 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL6672448 0.87
SCHEMBL11467053 0.79 CASP2 (0.42) TSHRANPEPPKMMAPTMEN1
SCHEMBL11474159 0.78
SCHEMBL6672469 0.78
SCHEMBL16925398 0.77 SLC6A2 (0.32) TSHRMEN1KMT2A
SCHEMBL9122680 0.76
SCHEMBL6672159 0.76
Hydrochloric Acid SCHEMBL22771817 0.75 TSHR (0.41) TSHRALDH1A1ANPEPERAP2ADH1B
SCHEMBL20592385 0.75 TSHR (0.50) TSHRALDH1A1ANPEPERAP2ADH1B
SCHEMBL4327881 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289973-B1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEM CO (US) 2004-10-06 EP claimed
EP-1289973-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2003-03-12 EP claimed
WO-2001098285-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2001-12-27 WO claimed
US-6270739-B1 CARBON DIOXIDE AT LOW PARTIAL PRESSURE IS ABSORBED INTO AN ALKANOLAMINE SOLUTION FROM A LOW PRESSURE RECYCLE GAS STREAM CONTAINING HIGH LEVELS OF OXYGEN. EASTMAN CHEMICAL COMPANY 2001-08-07 US claimed
EP-1289973-B1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEM CO (US) 2004-10-06 EP disclosed
EP-1289973-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2003-03-12 EP disclosed
WO-2001098285-A1 PROCESS FOR THE REMOVAL OF CARBON DIOXIDE FROM 3,4-EPOXY-1-BUTENE PROCESS RECYCLE STREAMS EASTMAN CHEMICAL COMPANY (US) 2001-12-27 WO disclosed
US-6270739-B1 CARBON DIOXIDE AT LOW PARTIAL PRESSURE IS ABSORBED INTO AN ALKANOLAMINE SOLUTION FROM A LOW PRESSURE RECYCLE GAS STREAM CONTAINING HIGH LEVELS OF OXYGEN. EASTMAN CHEMICAL COMPANY 2001-08-07 US disclosed