SCHEMBL31688987

SCHEMBL31688987

CC(C)(C)OC(=O)c1cccc(CCCN)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.60
CYP4F2 P78329 3/20 0.52
CYP4A11 Q02928 3/20 0.52
LOXL2 Q9Y4K0 1/20 0.50
DHODH Q02127 2/20 0.43
STAT3 P40763 1/20 0.40
FOLH1 Q04609 1/20 0.39
ACHE P22303 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 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
SCHEMBL7504785 0.91 SLC7A5 (0.63) SLC7A5CYP4F2CYP4A11LOXL2DHODH
SCHEMBL14415229 0.87 CYP4A11 (0.68) SLC7A5CYP4F2CYP4A11LOXL2DHODH
SCHEMBL25961093 0.87 SLC7A5 (0.58) SLC7A5CYP4F2CYP4A11LOXL2PPARG
SCHEMBL18744852 0.86 SLC7A5 (0.56) SLC7A5CYP4F2CYP4A11LOXL2DHODH
SCHEMBL4928282 0.85 LOXL2 (0.69) SLC7A5CYP4F2CYP4A11LOXL2STAT3
SCHEMBL7505386 0.84 CYP4F2 (0.69) SLC7A5CYP4F2CYP4A11LOXL2DHODH
SCHEMBL5382573 0.84 SLC7A5 (0.60) SLC7A5CYP4F2CYP4A11LOXL2STAT3
SCHEMBL31487557 0.84 CYP4F2 (0.69) SLC7A5CYP4F2CYP4A11LOXL2DHODH
SCHEMBL5725416 0.84 CYP4A11 (0.73) SLC7A5CYP4F2CYP4A11LOXL2DHODH
Hydrochloric Acid SCHEMBL2316080 0.84 LOXL2 (0.67) SLC7A5CYP4F2CYP4A11LOXL2STAT3

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-20250296915-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2025-09-25 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-20250296915-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP SLC7A5 20/4885CYP4F2 3415/4885CYP4A11 4673/4885

“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.