SCHEMBL6290243

SCHEMBL6290243

CCNCCCCNC(=O)NCC

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.58
EPHX2 P34913 1/20 0.51
CYP2C19 P33261 2/20 0.50
CYP1A2 P05177 1/20 0.50
PAOX Q6QHF9 1/20 0.47
KDM1A O60341 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GLA P06280 1/20 0.46
PRMT1 Q99873 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL6287287 0.98 EPHX1 (0.61) EPHX1EPHX2CYP2C19CYP1A2PAOX
SCHEMBL6283812 0.95 CYP2C19 (0.52) EPHX1EPHX2CYP2C19CYP1A2PAOX
SCHEMBL12914936 0.91 EPHX1 (0.58) EPHX1EPHX2CYP2C19CYP1A2PAOX
SCHEMBL14198101 0.91 EPHX1 (0.68) EPHX1EPHX2MEN1KMT2APRMT1
SCHEMBL6286920 0.89 EPHX1 (0.72) EPHX1EPHX2CYP2C19CYP1A2PAOX
SCHEMBL12914917 0.89 EPHX1 (0.61) EPHX1EPHX2CYP2C19CYP1A2PAOX
SCHEMBL12913672 0.88 EPHX1 (0.54) EPHX1EPHX2CYP2C19CYP1A2PAOX
SCHEMBL10399741 0.88 EPHX1 (0.73) EPHX1EPHX2MEN1KMT2APRMT1
SCHEMBL6286349 0.87 EPHX1 (0.76) EPHX1EPHX2PAOXTSHR
SCHEMBL6290324 0.87 EPHX1 (0.69) EPHX1EPHX2PAOXTSHR

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