SCHEMBL6290136

SCHEMBL6290136

CCCCNC(CCC)C(CC)COC(=O)NCC

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.42
ACHE P22303 14/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36

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
SCHEMBL5247021 0.93 ACHE (0.50) ALOX15ACHE
SCHEMBL5246072 0.89 ACHE (0.49) ALOX15ACHE
SCHEMBL5247937 0.88 SMN1; SMN2 (0.44) ALOX15ACHESMN1; SMN2CHRNB2CHRNB4
SCHEMBL5246727 0.87 EPHX1 (0.41) ALOX15ACHECHRNB2CHRNA4
SCHEMBL5245068 0.83 CA1 (0.36) ALOX15ACHESMN1; SMN2
SCHEMBL6289603 0.82 SMN1; SMN2 (0.44) ALOX15ACHESMN1; SMN2CHRNB2CHRNB4
SCHEMBL5244825 0.82 ALOX15 (0.41) ALOX15ACHESMN1; SMN2CHRNB2CHRNB4
SCHEMBL5247298 0.82 ACHE (0.50) ALOX15ACHE
SCHEMBL6283796 0.77 EPHX1 (0.40) ACHE
SCHEMBL5245190 0.77 EPHX1 (0.38) SMN1; SMN2CHRNB2CHRNA4

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