SCHEMBL28061602

SCHEMBL28061602

CCCN(CCN)C(CCO)C(=O)OC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPOR P19235 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.33
MIF P14174 1/20 0.31
FDPS P14324 1/20 0.30

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
SCHEMBL15518639 0.81 CA2 (0.41) EPORCA1CA2ZDHHC7FDPS
Hydrochloric Acid SCHEMBL28045635 0.80 CA1 (0.33) CA1CA2ZDHHC7MIF
Hydrochloric Acid SCHEMBL27914620 0.80 CA1 (0.34) CA1CA2
SCHEMBL8377125 0.76 CA2 (0.49) EPORCA1CA2ZDHHC7
SCHEMBL8375570 0.71 GABRA1 (0.39) CA1CA2ZDHHC7
SCHEMBL16181536 0.69 CA1 (0.36) CA1CA2ZDHHC7MIF
SCHEMBL6885833 0.69 PAM (0.38) EPORZDHHC7
SCHEMBL8660845 0.68 KMT2A (0.43) CA1CA2ZDHHC7FDPS
SCHEMBL28245970 0.68 NR1H2 (0.39)
SCHEMBL3421909 0.67 CHRM1 (0.46) CA2

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
CN-104211619-B A kind of synthetic method of N-(2-Fmoc-aminoethyl) glycine methyl ester hydrochloride 苏州维泰生物技术有限公司 2016-08-17 CN disclosed