SCHEMBL16355779

SCHEMBL16355779

CC(C)(C)OC(=O)CCNCc1cccc(C(=O)OC(C)(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.55
LOXL2 Q9Y4K0 1/20 0.43
HIF1A Q16665 1/20 0.42
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
MEP1B Q16820 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
FOLH1 Q04609 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
ATM Q13315 1/20 0.38
STAT3 P40763 1/20 0.37
UNG P13051 1/20 0.37
SENP1 Q9P0U3 1/20 0.37
TSHR P16473 1/20 0.37
F2 P00734 1/20 0.36

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
SCHEMBL7611802 0.90 SLC7A5 (0.58) SLC7A5LOXL2HIF1ACYP4F2CYP4A11
SCHEMBL557761 0.90 MEP1B (0.51) SLC7A5HIF1AMEP1BNR1H4FOLH1
SCHEMBL22398380 0.88 SLC7A5 (0.49) SLC7A5LOXL2HIF1ACYP4F2CYP4A11
SCHEMBL16355834 0.87 SLC7A5 (0.57) SLC7A5LOXL2HIF1ACYP4F2CYP4A11
SCHEMBL15876029 0.87 SLC7A5 (0.54) SLC7A5LOXL2HIF1ACYP4F2CYP4A11
Hydrochloric Acid SCHEMBL17433718 0.86 SLC7A5 (0.53) SLC7A5LOXL2HIF1ACYP4F2CYP4A11
SCHEMBL13145859 0.84 SLC7A5 (0.42) SLC7A5LOXL2MEP1BNR1H4CA1
SCHEMBL16355830 0.84 SLC7A5 (0.56) SLC7A5LOXL2HIF1ACYP4F2CYP4A11
SCHEMBL9102803 0.82 ATM (0.52) CA1ATM
SCHEMBL1830056 0.81 LOXL2 (0.54) SLC7A5LOXL2HIF1ACYP4F2CYP4A11

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9199927-B2 Guanidinobenzoic acid compound ASTELLAS PHARMA INC. (JP) 2015-12-01 US disclosed
US-20140378459-A1 GUANIDINOBENZOIC ACID COMPOUND ASTELLAS PHARMA INC. (JP) 2014-12-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140378459-A1 GUANIDINOBENZOIC ACID COMPOUND SERPINB1, REN, SPINT2 SLC7A5 1735/4885LOXL2 2517/4885HIF1A 2136/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.