SCHEMBL5250653

SCHEMBL5250653

CCCCNC(=O)OCCOCCOCCNCC

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.71
EPHX1 P07099 1/20 0.43

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
SCHEMBL5246064 1.00 ACHE (0.71) ACHEEPHX1
SCHEMBL5247229 0.92 ACHE (0.73) ACHEEPHX1
SCHEMBL5245754 0.92 ACHE (0.73) ACHEEPHX1
SCHEMBL23518844 0.90 ACHE (0.55) ACHE
SCHEMBL5244850 0.90 ACHE (0.75) ACHEEPHX1
SCHEMBL14451907 0.88 ACHE (0.79) ACHEEPHX1
Hydrochloric Acid SCHEMBL9773770 0.88 ACHE (0.72) ACHEEPHX1
SCHEMBL5246760 0.87 ACHE (0.61) ACHE
SCHEMBL5246582 0.87 ACHE (0.61) ACHE
SCHEMBL5248215 0.86 ACHE (0.48) ACHE

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-1379598-B1 UNSATURATED COMPOUNDS CONTAINING CARBAMATE TERMINAL GROUPS OR UREA TERMINAL GROUPS BASF AG (DE) 2007-09-12 EP disclosed
US-6916854-B2 Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20040097642-A1 Unsaturated compounds containing carbamate terminal groups or urea terminal groups BASF AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed