SCHEMBL18079474

SCHEMBL18079474

CCN(CCCC(N)(CCCCB(C)O)C(=O)O)Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ARG2 P78540 14/20 0.48
▸ ARG1 P05089 13/20 0.48
▸ SIGMAR1 Q99720 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL10006260 0.93 ARG1 (0.58) ARG2ARG1
SCHEMBL18079487 0.88 ARG2 (0.43) ARG2ARG1SIGMAR1
SCHEMBL18079469 0.85 ARG1 (0.54) ARG2ARG1
SCHEMBL10006164 0.81 ARG1 (0.52) ARG2ARG1SIGMAR1
SCHEMBL18079494 0.80 ARG1 (0.40) ARG2ARG1SIGMAR1MAPK1
SCHEMBL18079492 0.78 ATM (0.44) ARG2ARG1SIGMAR1MAPK1
SCHEMBL18079470 0.78 ARG1 (0.57) ARG2ARG1
SCHEMBL10006499 0.78 ARG1 (0.65) ARG2ARG1
SCHEMBL18079486 0.76 ARG2 (0.46) ARG2ARG1SIGMAR1
SCHEMBL18079473 0.75 ARG2 (0.47) ARG2ARG1

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-9447122-B2 Arginase inhibitors and methods of use thereof ASTRAZENECA AB (SE) 2016-09-20 — — US disclosed
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