SCHEMBL6284907

SCHEMBL6284907

CCCCNC(=O)NCCCCNC

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.75
EPHX2 P34913 7/20 0.49
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
CASP2 P42575 1/20 0.47

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
SCHEMBL6289706 0.98 EPHX1 (0.79) EPHX1EPHX2CASP2
SCHEMBL6283837 0.95 EPHX1 (0.68) EPHX1EPHX2MMP1MMP2
SCHEMBL6290325 0.91 EPHX1 (0.68) EPHX1EPHX2MMP1MMP2
SCHEMBL30786047 0.91 EPHX1 (0.90) EPHX1EPHX2MMP1MMP2CASP2
SCHEMBL17133784 0.88 EPHX1 (0.95) EPHX1EPHX2CASP2
SCHEMBL320112 0.88 EPHX1 (0.85) EPHX1MMP1MMP2
SCHEMBL6285139 0.86 EPHX1 (0.58) EPHX1EPHX2
SCHEMBL6290340 0.86 EPHX1 (0.57) EPHX1EPHX2
SCHEMBL25227097 0.86 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL11258951 0.86 EPHX1 (1.00) EPHX1EPHX2CASP2

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