SCHEMBL29932268

SCHEMBL29932268

C[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)CSSC[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CCCNC(N)=O)NC1=O

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 6/20 0.66
▸ F12 P00748 13/20 0.59
▸ KLK7 P49862 1/20 0.56
▸ KLKB1 P03952 1/20 0.55
▸ PLG P00747 1/20 0.54

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
SCHEMBL29932166 1.00 CXCR4 (0.66) CXCR4F12KLK7KLKB1PLG
SCHEMBL29932260 0.99 CXCR4 (0.68) CXCR4F12KLK7KLKB1PLG
SCHEMBL29932248 0.99 CXCR4 (0.68) CXCR4F12KLK7KLKB1PLG
SCHEMBL29932186 0.97 CXCR4 (0.65) CXCR4F12KLK7KLKB1
SCHEMBL29932059 0.97 CXCR4 (0.68) CXCR4F12KLKB1
SCHEMBL29932154 0.97 CXCR4 (0.68) CXCR4F12KLKB1
SCHEMBL29932269 0.97 CXCR4 (0.68) CXCR4F12KLKB1
SCHEMBL29836096 0.97 CXCR4 (0.68) CXCR4F12KLKB1
SCHEMBL29932113 0.94 CXCR4 (0.60) CXCR4F12
SCHEMBL29932187 0.94 CXCR4 (0.64) CXCR4F12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11648293-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-05-16 — — US disclosed
US-11642393-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-05-09 — — US disclosed
US-11638742-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-05-02 — — US disclosed
US-11638743-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-05-02 — — US disclosed
US-20230104343-A1 CXCR4 INHIBITOR FOR THE TREATMENT OF ACUTE RESPIRATORY DISTRESS SYNDROME AND VIRAL INFECTIONS BIOLINERX LTD. (IL) 2023-04-06 — — US disclosed
US-11612638-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-03-28 — — US disclosed
US-11607444-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-03-21 — — US disclosed
US-11596666-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-03-07 — — US disclosed
US-11590200-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-02-28 — — US disclosed
US-11559562-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-01-24 — — US disclosed
US-11554159-B2 Compositions and methods for treating cancer Blokine Therapeutics Ltd. (IL) 2023-01-17 — — US disclosed
US-11534478-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2022-12-27 — — US disclosed
US-20220288155-A1 CXCR4 INHIBITOR FOR THE TREATMENT OF ACUTE RESPIRATORY DISTRESS SYNDROME AND VIRAL INFECTIONS BIOLINERX LTD. (IL) 2022-09-15 — — 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-11638742-B2 Compositions and methods for treating cancer CD274, PDCD1, PDCD1LG2 CXCR4 10/4885F12 4223/4885KLK7 591/4885

“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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