SCHEMBL18280876

SCHEMBL18280876

O=C(O)CS[C@@]1(C(=O)O)CCCN1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.35
ARG2 P78540 1/20 0.35
PKM P14618 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2C19 P33261 2/20 0.31
CYP2D6 P10635 2/20 0.30
HIF1A Q16665 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
SCHEMBL5029633 0.82 TSHR (0.35) ARG1ARG2
SCHEMBL9297313 0.81 ARG1 (0.35) ARG1ARG2
SCHEMBL7339201 0.81 ARG1 (0.35) ARG1ARG2
SCHEMBL7339204 0.81 ARG1 (0.35) ARG1ARG2
SCHEMBL6969192 0.76 ARG1 (0.35) ARG1ARG2
SCHEMBL7269187 0.75 ARG1 (0.34) ARG1ARG2
SCHEMBL10969403 0.74 SLC6A2 (0.37) L3MBTL1CYP2C19
SCHEMBL7340597 0.73 ARG1 (0.33) ARG1ARG2
SCHEMBL8936209 0.70 ARG1 (0.32) ARG1ARG2
SCHEMBL8936213 0.70 ARG1 (0.32) ARG1ARG2

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
US-20160355802-A1 Compositions and Methods Of Use Thereof For Making Polypeptides With Many Instances Of Nonstandard Amino Acids YALE UNIVERSITY 2016-12-08 US disclosed