SCHEMBL25597280

SCHEMBL25597280

CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)CCCSC[C@@H](C(=O)N2CCC[C@H]2C(C)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OXTR P30559 15/20 0.79
▸ AVPR1A P37288 9/20 0.79
▸ AVPR2 P30518 8/20 0.79
▸ AVPR1B P47901 4/20 0.79

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
SCHEMBL19455871 0.90 OXTR (0.84) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL23118157 0.88 OXTR (1.00) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL39224 0.88 OXTR (1.00) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL19712191 0.88 OXTR (1.00) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL28528620 0.88 OXTR (1.00) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL19745049 0.88 OXTR (0.97) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL23118139 0.88 OXTR (0.91) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL23118120 0.88 OXTR (0.91) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL3128368 0.88 OXTR (0.96) OXTRAVPR1AAVPR2AVPR1B
Carbetocin SCHEMBL23118109 0.87 OXTR (0.92) OXTRAVPR1AAVPR2AVPR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174480-A1 FLUOROGENIC DIMER COMPOUND, USEFUL AS A PROBE FOR DETECTION OF ENDOGENOUS RECEPTORS UNIVERSITE DE STRASBOURG (FR) 2023-06-08 — — 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-20230174480-A1 FLUOROGENIC DIMER COMPOUND, USEFUL AS A PROBE FOR DETECTION OF ENDOGENOUS RECEPTORS GPR3, GPR174, GPR139 OXTR 140/4885AVPR1A 494/4885AVPR2 526/4885

“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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