SCHEMBL20683397

SCHEMBL20683397

BCCCCC(N)(C(=O)O)C1CCN(C(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 10/20 0.58
ARG2 P78540 10/20 0.58
MAPT P10636 1/20 0.51
MGLL Q99685 7/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL895432 0.88 ARG1 (0.74) ARG1ARG2MAPTMGLL
Hydrochloric Acid SCHEMBL895384 0.87 ARG1 (0.73) ARG1ARG2MAPTMGLL
SCHEMBL20683402 0.85 ARG1 (0.60) ARG1ARG2MEN1KMT2A
SCHEMBL20683503 0.84 ARG1 (0.79) ARG1ARG2MAPTKMT2A
SCHEMBL20683417 0.83 ARG1 (0.65) ARG1ARG2ALDH1A1
SCHEMBL20683518 0.79 ARG1 (0.51) ARG1ARG2MAPT
SCHEMBL895148 0.77 ARG1 (0.69) ARG1ARG2
SCHEMBL20683534 0.77 ARG1 (0.50) ARG1ARG2MAPT
Hydrochloric Acid SCHEMBL894453 0.76 ARG1 (0.68) ARG1ARG2
SCHEMBL20683443 0.75 ARG1 (0.63) ARG1ARG2MAPTMEN1KMT2A

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