SCHEMBL27124358

SCHEMBL27124358

CC(C)(CC(N)Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.53
▸ BLM P54132 1/20 0.50
▸ TAAR1 Q96RJ0 3/20 0.49
▸ SLC6A2 P23975 1/20 0.49
▸ ESR1 P03372 3/20 0.42
▸ ESR2 Q92731 3/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ ANPEP P15144 2/20 0.41
▸ ENPEP Q07075 2/20 0.41
▸ MME P08473 1/20 0.41
▸ CTSS P25774 1/20 0.40
▸ CTSK P43235 1/20 0.40

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
SCHEMBL24140474 1.00 SLC7A5 (0.53) SLC7A5BLMTAAR1SLC6A2ESR1
SCHEMBL22154816 0.87 ANPEP (0.41) SLC7A5ANPEPENPEPMME
SCHEMBL25831733 0.87 ENPEP (0.41) SLC7A5BLMANPEPENPEPMME
SCHEMBL22154657 0.87 ANPEP (0.41) SLC7A5ANPEPENPEPMME
SCHEMBL25818343 0.87 ENPEP (0.41) SLC7A5BLMANPEPENPEPMME
SCHEMBL17728729 0.87 EPHX1 (0.53) SLC7A5TAAR1SLC6A2ANPEPMME
SCHEMBL17728727 0.87 EPHX1 (0.53) SLC7A5TAAR1SLC6A2ANPEPMME
SCHEMBL28208789 0.87 EPHX1 (0.53) SLC7A5TAAR1SLC6A2ANPEPMME
SCHEMBL22121182 0.86 MME (0.44) ANPEPENPEPMMECTSSCTSK
SCHEMBL22154818 0.86 DPP4 (0.42) SLC7A5ANPEPENPEPMME

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-20230414775-A1 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. 2023-12-28 — — US disclosed
WO-2023129518-A1 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2023-07-06 — — WO 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-20230414775-A1 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES SDCBP, TEK, TEKT1 SLC7A5 1331/4885BLM 3791/4885TAAR1 2913/4885

“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.

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