SCHEMBL29459539

SCHEMBL29459539

CC(C)C[C@@H](N)C(=O)NCC(=O)N[C@@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CS)C(=O)O)[C@H](C)O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 6/20 0.53
▸ OPRD1 P41143 6/20 0.53
▸ OPRK1 P41145 5/20 0.51
▸ CTSB P07858 1/20 0.47

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
SCHEMBL30400934 0.88 IL23R (0.52) OPRM1OPRD1OPRK1
SCHEMBL31463658 0.87 OPRM1 (0.53) OPRM1OPRD1OPRK1CTSB
SCHEMBL29569125 0.87 OPRK1 (0.52) OPRM1OPRD1OPRK1CTSB
SCHEMBL29530923 0.86 OPRD1 (0.55) OPRM1OPRD1OPRK1CTSB
SCHEMBL29789569 0.85 OPRK1 (0.54) OPRM1OPRD1OPRK1
SCHEMBL30658171 0.85 OPRK1 (0.55) OPRM1OPRK1
SCHEMBL30435360 0.85 OPRK1 (0.54) OPRM1OPRD1OPRK1CTSB
SCHEMBL29568724 0.84 OPRK1 (0.59) OPRM1OPRD1OPRK1CTSB
SCHEMBL29569067 0.84 OPRK1 (0.50) OPRM1OPRD1OPRK1CTSB
SCHEMBL2777114 0.84 OPRK1 (0.59) OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12514937-B2 Methods for detecting CCR2 receptors WASHINGTON UNIVERSITY (US) 2026-01-06 — — US disclosed
US-20240299598-A1 METHODS FOR DETECTING CCR2 RECEPTORS WASHINGTON UNIVERSITY (US) 2024-09-12 — — US disclosed
US-12016935-B2 Methods for detecting CCR2 receptors WASHINGTON UNIVERSITY (US) 2024-06-25 — — US disclosed
US-20230381349-A1 METHODS AND COMPOSITIONS FOR IMAGING AND TREATING CANCER WASHINGTON UNIVERSITY (US) 2023-11-30 — — US disclosed
WO-2022076523-A1 METHODS AND COMPOSITIONS FOR IMAGING AND TREATING CANCER WASHINGTON UNIVERSITY (US) 2022-04-14 — — 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-12016935-B2 Methods for detecting CCR2 receptors CCR2, CCR1, CCR5 OPRM1 270/4885OPRD1 533/4885OPRK1 236/4885
US-20240299598-A1 METHODS FOR DETECTING CCR2 RECEPTORS CCR2, CCR1, CCR5 OPRM1 270/4885OPRD1 533/4885OPRK1 236/4885

“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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