SCHEMBL6286485

SCHEMBL6286485

CCCCNC(C)CNC(N)=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.40
ALOX15 P16050 1/20 0.38
ACHE P22303 5/20 0.36
MMP2 P08253 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
MEN1 O00255 1/20 0.35
FAAH O00519 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
BCHE P06276 1/20 0.35

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
SCHEMBL6287231 0.81 EPHX1 (0.61) EPHX1ACHEMMP2
SCHEMBL6283546 0.80 BCAT2 (0.36) SIGMAR1
SCHEMBL6290269 0.80 EPHX1 (0.46) EPHX1ACHEMMP2
SCHEMBL6287477 0.80 EPHX1 (0.50) EPHX1ACHEMMP2FAAH
SCHEMBL11762956 0.78 EPHX1 (0.47) EPHX1DPP7FAAHMAPK1
SCHEMBL42513 0.75
SCHEMBL27301461 0.74 ALOX15 (0.40) ALOX15SIGMAR1
SCHEMBL6289718 0.74 CA1 (0.35) EPHX1ALOX15ACHEMMP2DPP7
Hydrochloric Acid SCHEMBL30786046 0.73 EPHX1 (0.54) EPHX1ALOX15ACHEMMP2GRIN2D
Hydrochloric Acid SCHEMBL8718943 0.73

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