SCHEMBL18079487

SCHEMBL18079487

CB(O)CCCCC(N)(CCCN(C)Cc1ccc(Cl)c(Cl)c1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ARG2 P78540 12/20 0.43
▸ ARG1 P05089 11/20 0.43
▸ SIGMAR1 Q99720 5/20 0.41
▸ TMEM97 Q5BJF2 1/20 0.41
▸ ATM Q13315 2/20 0.38
▸ PYCR1 P32322 1/20 0.38

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
SCHEMBL10006164 0.93 ARG1 (0.52) ARG2ARG1SIGMAR1
SCHEMBL18079494 0.92 ARG1 (0.40) ARG2ARG1SIGMAR1TMEM97ATM
SCHEMBL18079492 0.90 ATM (0.44) ARG2ARG1SIGMAR1TMEM97ATM
SCHEMBL18079486 0.88 ARG2 (0.46) ARG2ARG1SIGMAR1TMEM97
SCHEMBL18079474 0.88 ARG2 (0.48) ARG2ARG1SIGMAR1
SCHEMBL18079472 0.87 TMEM97 (0.44) ARG2ARG1SIGMAR1TMEM97PYCR1
SCHEMBL10006086 0.85 ARG2 (0.48) ARG2ARG1SIGMAR1TMEM97
SCHEMBL18079490 0.84 ARG1 (0.44) ARG2ARG1SIGMAR1TMEM97PYCR1
SCHEMBL10006244 0.82 ARG2 (0.46) ARG2ARG1SIGMAR1TMEM97ATM
SCHEMBL10006166 0.81 ARG1 (0.55) 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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