SCHEMBL6284541

SCHEMBL6284541

CCCCNCCCOCCCNC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.47
MAPT P10636 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PAOX Q6QHF9 1/20 0.43
TSHR P16473 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
EPHX1 P07099 2/20 0.41
EPHX2 P34913 1/20 0.40

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
SCHEMBL6289727 0.89 CYP1A2 (0.45) ACHEPAOXTSHRSMN1; SMN2EPHX2
SCHEMBL6290135 0.88 KDM4E (0.45) ACHEPAOXTSHRSMN1; SMN2EPHX2
SCHEMBL6290119 0.87 SAT1 (0.42) ACHEMAPTHSD17B10PAOXTSHR
SCHEMBL15019063 0.87 EPHX2 (0.43) ACHEMAPTHSD17B10TSHRRECQL
SCHEMBL6286823 0.87 PAOX (0.50) ACHEPAOXTSHREPHX1
SCHEMBL6285171 0.87 PAOX (0.55) ACHEPAOXTSHREPHX1
SCHEMBL6290147 0.85 EPHX1 (0.59) ACHEMAPTHSD17B10EPHX1EPHX2
SCHEMBL6289694 0.85 EPHX1 (0.57) ACHEPAOXTSHREPHX1
SCHEMBL8958415 0.84 TSHR (0.41) ACHEMAPTHSD17B10TSHRRECQL
SCHEMBL6287178 0.83 PAOX (0.45) ACHEPAOXTSHREPHX1

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