SCHEMBL6289600

SCHEMBL6289600

CCCCNCCCOC(=O)NCCCC

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.79
EPHX2 P34913 2/20 0.50
EPHX1 P07099 1/20 0.50

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
SCHEMBL20580780 0.96 ACHE (0.79) ACHEEPHX2EPHX1
SCHEMBL5247986 0.94 ACHE (0.82) ACHEEPHX2EPHX1
SCHEMBL5245194 0.93 ACHE (0.69) ACHEEPHX2
SCHEMBL5246718 0.93 ACHE (0.73) ACHEEPHX2
SCHEMBL5244780 0.93 ACHE (0.86) ACHEEPHX2EPHX1
SCHEMBL5246533 0.92 ACHE (0.78) ACHEEPHX1
SCHEMBL5249896 0.91 ACHE (0.65) ACHEEPHX1
SCHEMBL9812806 0.90 ACHE (0.81) ACHEEPHX1
SCHEMBL3975468 0.90 ACHE (0.88) ACHEEPHX2EPHX1
SCHEMBL20588996 0.89 ACHE (0.79) ACHEEPHX2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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