SCHEMBL31243858

SCHEMBL31243858

CC(C)[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.55
▸ OPRD1 P41143 11/20 0.55
▸ OPRM1 P35372 9/20 0.55
▸ OPRK1 P41145 2/20 0.55
▸ IL23R Q5VWK5 4/20 0.51

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
SCHEMBL31243945 0.98 OPRD1 (0.56) TFPIOPRD1OPRM1OPRK1IL23R
SCHEMBL31243861 0.95 OPRD1 (0.62) TFPIOPRD1OPRM1OPRK1
SCHEMBL31243862 0.94 OPRD1 (0.58) TFPIOPRD1OPRM1OPRK1IL23R
SCHEMBL31243890 0.94 OPRM1 (0.57) TFPIOPRD1OPRM1OPRK1IL23R
SCHEMBL31243855 0.94 OPRD1 (0.59) TFPIOPRD1OPRM1OPRK1
SCHEMBL31243925 0.94 TFPI (0.60) TFPIOPRD1OPRM1OPRK1IL23R
SCHEMBL31243884 0.92 OPRD1 (0.57) OPRD1OPRM1OPRK1IL23R
SCHEMBL30712924 0.91 TFPI (0.61) TFPIOPRD1OPRM1OPRK1
SCHEMBL31243883 0.91 BACE1 (0.56) TFPIOPRD1
SCHEMBL29701318 0.91 OPRD1 (0.57) OPRD1OPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263393-A1 FAP INHIBITORS SHANGHAI SINOTAU BIOTECH. CO., LTD (CN) 2025-08-21 — — US disclosed
CN-120202191-A Inhibitors of prostate specific membrane antigen and uses thereof 上海先通生物科技有限公司 2025-06-24 — — CN disclosed
CN-119072472-A FAP inhibitors 上海先通生物科技有限公司 2024-12-03 — — CN 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-20250263393-A1 FAP INHIBITORS FAP, APC, FIBP TFPI 6/4885OPRD1 4807/4885OPRM1 4813/4885

“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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