SCHEMBL6290264

SCHEMBL6290264

CCCCNCC(C)(CNCCCC)CNC(=O)NC

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.40
MMP2 P08253 2/20 0.35
MMP1 P03956 1/20 0.35
TSHR P16473 1/20 0.34
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
GAA P10253 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KDM4C Q9H3R0 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
SCHEMBL6284150 0.88 EPHX1 (0.55) EPHX1MMP2MMP1PAOXACHE
SCHEMBL6287185 0.86 EPHX1 (0.44) EPHX1MMP2MMP1TSHRPAOX
SCHEMBL6287199 0.86 EPHX1 (0.40) EPHX1MMP2MMP1TSHRPAOX
SCHEMBL6287542 0.84 EPHX1 (0.41) EPHX1MMP2MMP1TSHRPAOX
SCHEMBL6285506 0.82 HSD17B10 (0.31)
SCHEMBL6286748 0.81 EPHX1 (0.39) EPHX1MMP2MMP1TSHRPAOX
SCHEMBL6285523 0.81 EPHX1 (0.37) EPHX1MMP2TSHRPAOXACHE
SCHEMBL6287085 0.79 EPHX1 (0.53) EPHX1MMP2MMP1TSHRACHE
SCHEMBL6287780 0.77 EPHX1 (0.55) EPHX1MMP2MMP1ACHEKDM4C
SCHEMBL6289669 0.76 EPHX1 (0.63) EPHX1MMP2MMP1TSHRPAOX

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