SCHEMBL29700297

SCHEMBL29700297

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.66
▸ C5AR1 P21730 2/20 0.61
▸ CALCR P30988 4/20 0.60
▸ F2 P00734 4/20 0.58
▸ KDM1A O60341 2/20 0.57
▸ TFPI P10646 2/20 0.56

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
SCHEMBL29749731 0.97 APLNR (0.68) APLNRC5AR1CALCRF2KDM1A
SCHEMBL30141845 0.97 APLNR (0.68) APLNRC5AR1CALCRF2KDM1A
SCHEMBL30712933 0.92 C5AR1 (0.62) APLNRC5AR1CALCRKDM1A
SCHEMBL31182931 0.91 CALCR (0.65) APLNRC5AR1CALCRF2
SCHEMBL31182976 0.90 CALCR (0.70) APLNRCALCRF2
SCHEMBL31307221 0.90 C5AR1 (0.57) APLNRC5AR1CALCR
SCHEMBL30437321 0.90 APLNR (0.66) APLNRC5AR1CALCRKDM1ATFPI
SCHEMBL31529687 0.89 CALCR (0.59) APLNRCALCRTFPI
SCHEMBL31529692 0.89 CALCR (0.59) APLNRCALCRTFPI
SCHEMBL30432183 0.89 F2 (0.59) APLNRCALCRF2KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113453720-B Dual ligand drug conjugate and uses thereof 同宜医药(苏州)有限公司 2025-05-06 — — CN claimed
CN-113453720-B Dual ligand drug conjugate and uses thereof 同宜医药(苏州)有限公司 2025-05-06 — — CN disclosed
US-20240100175-A1 MULTI-LIGAND DRUG CONJUGATES AND USES THEREOF COHERENT BIOPHARMA I LTD (HK) 2024-03-28 — — US disclosed
US-11571480-B2 Multi-ligand drug conjugates and uses thereof Coherent Biopharma I, Limited (HK) 2023-02-07 — — US disclosed
CN-111617250-B Multi-ligand drug couplet and application thereof 同宜医药(苏州)有限公司 2022-07-01 — — CN disclosed
US-20220175761-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF COHERENT BIOPHARMA SUZHOU LTD (CN) 2022-06-09 — — 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 (3 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-20240100175-A1 MULTI-LIGAND DRUG CONJUGATES AND USES THEREOF CD44, CD47, SELPLG APLNR 106/4885C5AR1 645/4885CALCR 1124/4885
US-20220175761-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF SLC10A1, CD47, SELPLG APLNR 459/4885C5AR1 340/4885CALCR 2389/4885
US-11571480-B2 Multi-ligand drug conjugates and uses thereof CD44, CD47, SELPLG APLNR 106/4885C5AR1 645/4885CALCR 1124/4885

“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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