SCHEMBL12679147

SCHEMBL12679147

CC(CC(C)(C)C(=N)N)N1CCCC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA13 Q8N1Q1 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
PIK3CD O00329 1/20 0.36
TSHR P16473 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
SCHEMBL19866030 0.79 LMNA (0.45) LMNACA12CA1CA2CA3
SCHEMBL12679149 0.76 LMNA (0.36) LMNACA12CA1CA2CA3
SCHEMBL12679146 0.76 LMNA (0.36) LMNACA12CA1CA2CA3
SCHEMBL28555019 0.73 LMNA (0.58) LMNACA12CA1CA2CA3
SCHEMBL12136491 0.73 LMNA (0.39) LMNACA12CA1CA2CA3
SCHEMBL319336 0.72 LMNA (0.51) LMNACA12CA1CA2CA3
SCHEMBL6962028 0.72 LMNA (0.51) LMNACA12CA1CA2CA3
SCHEMBL7418428 0.72 LMNA (0.51) LMNACA12CA1CA2CA3
SCHEMBL14446063 0.72 LMNA (0.41) LMNACA12CA1CA2CA3
SCHEMBL20124938 0.71 LMNA (0.50) LMNACA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273802-B2 Silicones formed from an oxygen permeable component and a vinyl carbonate, carbamate ester or amide beta-substituted vinyl pyrrolidone; improve wettability of the lens without a surface treatment JOHNSON & JOHNSON VISION CARE, INC. (US) 2012-09-25 US disclosed
US-20080275156-A1 WETTABLE HYDROGELS COMPRISING REACTIVE, HYDROPHILIC, POLYMERIC INTERNAL WETTING AGENTS JOHNSON & JOHNSON VISION CARE, INC. 2008-11-06 US disclosed
US-7249848-B2 Wettable hydrogels comprising reactive, hydrophilic, polymeric internal wetting agents JOHNSON & JOHNSON VISION CARE, INC. (US) 2007-07-31 US disclosed