SCHEMBL6285645

SCHEMBL6285645

CCNC(=O)OCCCNC

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.53
CHRNB2 P17787 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA4 P43681 1/20 0.47
EPHX1 P07099 1/20 0.46

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
SCHEMBL5246717 0.94 ACHE (0.56) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5249158 0.93 ACHE (0.47) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6290429 0.92 ACHE (0.59) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5245110 0.88 ACHE (0.50) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL23834266 0.86 CHRNB2 (0.49) ACHECHRNB2CHRNB4CHRNA3CHRNA4
Hydrochloric Acid SCHEMBL23834268 0.86 CHRNB2 (0.49) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16673943 0.85 ACHE (0.63) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5248066 0.85 ACHE (0.76) ACHEEPHX1
SCHEMBL5244108 0.84 ACHE (0.53) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10812054 0.83 ACHE (0.67) ACHECHRNB2CHRNB4CHRNA3CHRNA4

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 4 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
EP-1379598-A1 UNSATURATED COMPOUNDS CONTAINING CARBAMATE TERMINAL GROUPS OR UREA TERMINAL GROUPS BASF AKTIENGESELLSCHAFT (DE) 2004-01-14 EP disclosed
WO-2002086000-A1 UNSATURATED COMPOUNDS CONTAINING CARBAMATE TERMINAL GROUPS OR UREA TERMINAL GROUPS BASF AKTIENGESELLSCHAFT (DE) 2002-10-31 WO disclosed