SCHEMBL6286750

SCHEMBL6286750

CNCCCOCCCNC(=O)NC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
MAPT P10636 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TSHR P16473 3/20 0.42
EPHX2 P34913 6/20 0.40
EPHX1 P07099 2/20 0.38

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
SCHEMBL6290323 0.86 KEAP1 (0.42) KEAP1NFE2L2MAPTHSD17B10TSHR
SCHEMBL6285158 0.85 KEAP1 (0.55) KEAP1NFE2L2EPHX1
SCHEMBL6287670 0.85 KEAP1 (0.50) KEAP1NFE2L2HSD17B10EPHX1
SCHEMBL6290340 0.85 EPHX1 (0.57) MAPTHSD17B10EPHX2EPHX1
SCHEMBL6287617 0.85 MAPT (0.44) MAPTHSD17B10TSHREPHX2EPHX1
SCHEMBL6290526 0.83 KMT2A (0.44) KEAP1NFE2L2MAPTHSD17B10EPHX2
SCHEMBL6280459 0.83 MAPT (0.43) KEAP1NFE2L2MAPTHSD17B10TSHR
SCHEMBL6289749 0.83 EPHX1 (0.54) KEAP1NFE2L2EPHX1
SCHEMBL6284129 0.82 MAPT (0.49) MAPTHSD17B10EPHX2EPHX1
SCHEMBL21997079 0.82 ALDH1A1 (0.41) MAPTHSD17B10TSHR

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