SCHEMBL30078092

SCHEMBL30078092

N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](N)CCC(=O)O)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 6/20 0.54
▸ OPRK1 P41145 6/20 0.54
▸ NMUR2 Q9GZQ4 7/20 0.53
▸ NMUR1 Q9HB89 7/20 0.53
▸ IL23R Q5VWK5 1/20 0.51
▸ CXCR4 P61073 2/20 0.51
▸ KDM1A O60341 3/20 0.50
▸ MAOB P27338 1/20 0.50
▸ KDM5A P29375 1/20 0.50
▸ KDM1B Q8NB78 1/20 0.50

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
SCHEMBL30078177 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078040 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078137 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078054 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078178 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078205 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078127 0.99 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078198 0.96 NMUR2 (0.56) OPRM1OPRK1NMUR2NMUR1CXCR4
SCHEMBL30078070 0.96 OPRM1 (0.55) OPRM1OPRK1NMUR2NMUR1IL23R
SCHEMBL30078129 0.96 OPRM1 (0.55) OPRM1OPRK1NMUR2NMUR1IL23R

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 12 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-11638743-B2 Compositions and methods for treating cancer BIOKINE THERAPEUTICS LTD. (IL) 2023-05-02 — — US disclosed
US-11638742-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

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 OPRM1 727/4885OPRK1 804/4885NMUR2 2199/4885

“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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