SCHEMBL13614191

SCHEMBL13614191

CCCNS(=O)(=O)c1cn(C)c(C)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
NLRP3 Q96P20 1/20 0.41
KDM4E B2RXH2 1/20 0.40
TRIM24 O15164 3/20 0.40
S1PR1 P21453 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
KMT2A Q03164 1/20 0.36
THRB P10828 1/20 0.36
CYP17A1 P05093 1/20 0.35
UTS2R Q9UKP6 1/20 0.35

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
SCHEMBL13359253 0.87 LMNA (0.49) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL6099656 0.82 LMNA (0.48) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL12824692 0.79 LMNA (0.43) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL14845715 0.78 LMNA (0.45) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL14968743 0.78 LMNA (0.56) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL12922882 0.75 LMNA (0.43) LMNATDP1NLRP3KDM4ETRIM24
Hydrochloric Acid SCHEMBL9400664 0.75 POLB (0.55) TDP1KDM4EKMT2A
SCHEMBL20381145 0.73 LMNA (0.43) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL12741150 0.72 LMNA (0.43) LMNATDP1NLRP3KDM4ETRIM24
SCHEMBL1641716 0.71 TDP1 (0.45) LMNATDP1NLRP3KDM4ETRIM24

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1432700-B1 SPIRO-HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BRISTOL MYERS SQUIBB CO (US) 2009-11-04 EP disclosed