SCHEMBL23943282

SCHEMBL23943282

CC(C)[C@H](NC(=O)CCOCCOCCOCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.40
▸ FURIN P09958 4/20 0.36
▸ MAP1LC3B Q9GZQ8 2/20 0.36
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ SIRT2 Q8IXJ6 3/20 0.33
▸ SIRT1 Q96EB6 2/20 0.33
▸ HRH1 P35367 1/20 0.32
▸ NPY1R P25929 1/20 0.32
▸ NPY2R P49146 1/20 0.32
▸ NPY4R P50391 1/20 0.32
▸ NPY5R Q15761 1/20 0.32
▸ OPRK1 P41145 1/20 0.32

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
SCHEMBL24224636 1.00 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL22138625 1.00 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL27197502 1.00 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL25450085 1.00 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL16946352 1.00 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL24476142 0.99 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL22128021 0.99 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL22128022 0.99 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL32667737 0.99 FAP (0.40) FAPFURINMAP1LC3BHTTSMN1; SMN2
SCHEMBL21570028 0.94 FAP (0.39) FAPFURINMAP1LC3BHTTNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4562011-A1 IMMUNOMODULATOR PURINE-DERIVED COMPOUNDS, CONJUGATES THEREOF, AND METHODS OF USE THEREOF Zymeworks BC Inc. (CA) 2025-06-04 — — EP disclosed
US-20250170266-A1 IMMUNOMODULATOR PURINE-DERIVED COMPOUNDS, CONJUGATES THEREOF, AND METHODS OF USE THEREOF ZYMEWORKS BC INC. (CA) 2025-05-29 — — US disclosed
US-20240124484-A1 IMIDAZOTHIENOPYRIDINE COMPOUNDS AND METHODS OF USE ZYMEWORKS BC INC (CA) 2024-04-18 — — US disclosed
WO-2024020684-A1 IMMUNOMODULATOR PURINE-DERIVED COMPOUNDS, CONJUGATES THEREOF, AND METHODS OF USE THEREOF ZYMEWORKS BC INC. (CA) 2024-02-01 — — WO disclosed
US-20230022596-A1 NEOANTIGEN-ELICITING ANTIBODY DRUG CONJUGATES FOR THE IMMUNOTHERAPY OF CANCER HURT CLARENCE (US) 2023-01-26 — — US disclosed
WO-2022126263-A1 IMIDAZOTHIENOPYRIDINE COMPOUNDS AND METHODS OF USE ZYMEWORKS INC. (CA) 2022-06-23 — — WO disclosed
US-20210324031-A1 COMPOUNDS, COMPOSITIONS, METHODS, AND USES FOR TREATING LEPTIN RESISTANCE, OBESITY, DIABETES MELLITUS AND METABOLIC SYNDROME LINK THERAPEUTICS, LLC 2021-10-21 — — 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 (4 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-20230022596-A1 NEOANTIGEN-ELICITING ANTIBODY DRUG CONJUGATES FOR THE IMMUNOTHERAPY OF CANCER TP53, KLK3, HLA-A FAP 478/4885FURIN 1131/4885MAP1LC3B 916/4885
US-20210324031-A1 COMPOUNDS, COMPOSITIONS, METHODS, AND USES FOR TREATING LEPTIN RESISTANCE, OBESITY, DIABETES MELLITUS AND METABOLIC SYNDROME LIPE, GPR119, FABP4 FAP 219/4885FURIN 58/4885MAP1LC3B 1100/4885
US-20240124484-A1 IMIDAZOTHIENOPYRIDINE COMPOUNDS AND METHODS OF USE DHFR, RARS2, DPYD FAP 3819/4885FURIN 1760/4885MAP1LC3B 4677/4885
US-20250170266-A1 IMMUNOMODULATOR PURINE-DERIVED COMPOUNDS, CONJUGATES THEREOF, AND METHODS OF USE THEREOF PAICS, ENTPD5, PNP FAP 1044/4885FURIN 3338/4885MAP1LC3B 4172/4885

“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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