SCHEMBL20683403

SCHEMBL20683403

BCCCCC(N)(C(=O)O)C1CCN(Cc2ccc(F)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 11/20 0.56
ARG2 P78540 11/20 0.56
SIGMAR1 Q99720 2/20 0.42
GRM2 Q14416 1/20 0.41
GRM3 Q14832 1/20 0.41

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
SCHEMBL20683471 0.90 ARG1 (0.67) ARG1ARG2GRM2GRM3
SCHEMBL20683465 0.89 ARG1 (0.59) ARG1ARG2SIGMAR1
SCHEMBL20683481 0.89 ARG1 (0.56) ARG1ARG2
SCHEMBL895591 0.89 ARG1 (0.73) ARG1ARG2
SCHEMBL895593 0.89 ARG1 (0.73) ARG1ARG2
Hydrochloric Acid SCHEMBL894718 0.88 ARG1 (0.71) ARG1ARG2
Hydrochloric Acid SCHEMBL894564 0.88 ARG1 (0.71) ARG1ARG2
Hydrochloric Acid SCHEMBL894563 0.88 ARG1 (0.71) ARG1ARG2
SCHEMBL20683520 0.83 ARG1 (0.62) ARG1ARG2SIGMAR1
SCHEMBL10265155 0.83 ARG1 (0.77) ARG1ARG2SIGMAR1GRM2GRM3

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-2560978-B1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS INC (US) 2019-01-30 EP disclosed