SCHEMBL6284448

SCHEMBL6284448

CCCCNCC(C)(C)CNC(=O)NCC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.44
TSHR P16473 1/20 0.39
FAAH O00519 1/20 0.35
MMP2 P08253 2/20 0.35
MMP1 P03956 1/20 0.35
PAOX Q6QHF9 1/20 0.34
ACHE P22303 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
EPHX2 P34913 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL6280219 0.91 EPHX1 (0.55) EPHX1TSHRMMP2MMP1PAOX
SCHEMBL6286863 0.86 EPHX1 (0.53) EPHX1TSHRMMP2MMP1ACHE
SCHEMBL6287199 0.86 EPHX1 (0.40) EPHX1TSHRMMP2MMP1PAOX
SCHEMBL6287185 0.86 EPHX1 (0.44) EPHX1TSHRFAAHMMP2MMP1
SCHEMBL6289714 0.84 EPHX1 (0.46) EPHX1TSHRFAAHMMP2MMP1
SCHEMBL6290154 0.83 SMN1; SMN2 (0.37) EPHX1TSHRMMP2MMP1SMN1; SMN2
SCHEMBL6286898 0.81 EPHX1 (0.43) EPHX1TSHRFAAHMMP2MMP1
SCHEMBL6284226 0.81 EPHX1 (0.37) EPHX1TSHRMMP2PAOXACHE
SCHEMBL6284150 0.77 EPHX1 (0.55) EPHX1MMP2MMP1PAOXACHE
SCHEMBL6289592 0.77 EPHX1 (0.55) EPHX1MMP2MMP1ACHEEPHX2

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