SCHEMBL25615670

SCHEMBL25615670

CCCCN/C(=N/S(N)(=O)=O)NC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.44
CA1 P00915 4/20 0.44
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM1A O60341 1/20 0.40
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
EPHX1 P07099 4/20 0.38
CA12 O43570 3/20 0.38
CA7 P43166 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA3 P07451 2/20 0.37
CA4 P22748 2/20 0.37

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
SCHEMBL22645876 0.95 EPHX1 (0.42) CA2CA1MEN1HTTKMT2A
SCHEMBL18665149 0.85 MEN1 (0.43) CA2CA1MEN1HTTKMT2A
SCHEMBL21477768 0.81 KDM1A (0.37) KDM1A
SCHEMBL21473435 0.81 KDM1A (0.37) KDM1A
SCHEMBL19168536 0.80 EPHX1 (0.42) CA2CA1MEN1HTTKMT2A
SCHEMBL21230926 0.80 KDM1A (0.36) MEN1HTTKMT2AKDM1A
SCHEMBL27453924 0.77 CA2 (0.32) CA2CA1CA12CA7CA4
SCHEMBL23419432 0.76 KDM1A (0.33) KDM1A
SCHEMBL12344215 0.74 KDM1A (0.69) MEN1HTTKMT2AKDM1AGRIN2D
SCHEMBL19174253 0.73 CA2 (0.42) CA2CA1MEN1HTTKMT2A

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-4186888-A1 COMPOUND AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ModernaTX, Inc. (US) 2023-05-31 EP disclosed