SCHEMBL29816729

SCHEMBL29816729

C=CCOC(=O)OC(=O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.49
▸ TP53 P04637 3/20 0.49
▸ CASP3 P42574 4/20 0.49
▸ CASP1 P29466 3/20 0.44
▸ TNF P01375 1/20 0.44
▸ MDM2 Q00987 4/20 0.43

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
SCHEMBL8037759 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL30826385 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL30641530 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL119369 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL30802532 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL29398340 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL10187049 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL29400275 0.92 CASP3 (0.53) MDM4TP53CASP3CASP1TNF
SCHEMBL29398655 0.90 TLR2 (0.48) MDM4TP53CASP3CASP1TNF
SCHEMBL31166669 0.90 CASP1 (0.50) MDM4TP53CASP3CASP1TNF

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
US-12564632-B2 Conjugates of biomolecule and use thereof YAFEI SHANGHAI BIOLOG MEDICINE SCIENCE & TECHNOLOGY CO., LTD. (CN) 2026-03-03 — — US disclosed
WO-2024200838-A1 NEW ODILORHABDINS ANALOGUES AS ANTIBIOTICS AGAINST MULTI-RESISTANT BACTERIA NOSOPHARM (FR) 2024-10-03 — — WO disclosed
US-20240271329-A1 CYCLIC COMPOUND LIBRARY AND CONSTRUCTION METHOD THEREFOR Yafei Shanghai Biology Medicine Science & Technology Co. Ltd. (CN) 2024-08-15 — — US disclosed
CN-111670051-B Biomolecular conjugates and uses thereof 亚飞(上海)生物医药科技有限公司 2024-06-25 — — CN disclosed
EP-4309665-A1 CYCLIC COMPOUND LIBRARY AND CONSTRUCTION METHOD THEREFOR Yafei Shanghai Biolog Medicine Science & Technology Co., Ltd. (CN) 2024-01-24 — — EP disclosed
US-20230158141-A1 Conjugates of Biomolecule and Use Thereof YAFEI SHANGHAI BIOLOG MEDICINE SCIENCE & TECHNOLOG (CN) 2023-05-25 — — US disclosed
WO-2022193902-A1 CYCLIC COMPOUND LIBRARY AND CONSTRUCTION METHOD THEREFOR 亚飞上海生物医药科技有限公司 2022-09-22 — — 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 (2 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-20230158141-A1 Conjugates of Biomolecule and Use Thereof CD47, FCGR2A, CD40 MDM4 3454/4885TP53 156/4885CASP3 237/4885
US-12564632-B2 Conjugates of biomolecule and use thereof FCGR2A, FCGR3B, TNFRSF9 MDM4 2149/4885TP53 35/4885CASP3 931/4885

“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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