SCHEMBL2297127

SCHEMBL2297127

CC(=CNC(N)=O)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.38
LMNA P02545 3/20 0.35
BLM P54132 2/20 0.35
PMP22 Q01453 2/20 0.35
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NFKB1 P19838 3/20 0.32
TSHR P16473 2/20 0.32
CYP1A2 P05177 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
THPO P40225 1/20 0.32
CA2 P00918 1/20 0.32
CYP3A4 P08684 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL21400261 0.84 CRBN (0.38) CRBNLMNABLMPMP22ALOX15
SCHEMBL24548415 0.84 CRBN (0.38) CRBNLMNABLMPMP22ALOX15
SCHEMBL27717261 0.84 CRBN (0.38) CRBNLMNABLMPMP22ALOX15
SCHEMBL26884 0.82 CRBN (0.36) CRBNLMNABLMPMP22ALOX15
SCHEMBL129220 0.82 CRBN (0.36) CRBNLMNABLMPMP22ALOX15
SCHEMBL24548438 0.80 TDP1 (0.38) CRBNLMNABLMPMP22ALOX15
SCHEMBL27927208 0.78 ALDH1A1 (0.37) CRBNLMNABLMPMP22ALOX15
SCHEMBL22084139 0.78
SCHEMBL2028292 0.77 TSHR (0.37) LMNATDP1TSHR
SCHEMBL6831180 0.76

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-7999050-B2 Process for production of polymer dispersions containing an acetoacetate moiety BASF SE (US) 2011-08-16 US claimed
US-7999050-B2 Process for production of polymer dispersions containing an acetoacetate moiety BASF SE (US) 2011-08-16 US disclosed