SCHEMBL26346709

SCHEMBL26346709

CCCCC(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCOP

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 3/20 0.50
▸ CTSB P07858 2/20 0.50
▸ CHRNB2 P17787 1/20 0.47
▸ CHRNB4 P30926 1/20 0.47
▸ CHRNA3 P32297 1/20 0.47
▸ CHRNA4 P43681 1/20 0.47
▸ FAAH O00519 2/20 0.47
▸ OPRD1 P41143 4/20 0.47
▸ OPRM1 P35372 3/20 0.47
▸ REN P00797 1/20 0.45
▸ CTSL P07711 1/20 0.45
▸ CTSS P25774 1/20 0.45
▸ PTPN1 P18031 2/20 0.45
▸ OPRK1 P41145 1/20 0.44

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
SCHEMBL23718677 0.88 FAAH (0.52) PSMB5CTSBCHRNB2CHRNB4CHRNA3
SCHEMBL26154325 0.85 FAAH (0.52) PSMB5FAAHPTPN1
SCHEMBL26154311 0.85 FAAH (0.52) PSMB5FAAHPTPN1
SCHEMBL25497019 0.84 FAAH (0.60) PSMB5CTSBCHRNB2CHRNB4CHRNA3
SCHEMBL24982484 0.83 FAAH (0.50) PSMB5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL25148144 0.83 FAAH (0.56) PSMB5CTSBCHRNB2CHRNB4CHRNA3
SCHEMBL24577164 0.82 FAAH (0.49) PSMB5FAAHPTPN1
SCHEMBL26154352 0.82 REN (0.45) PSMB5CTSBOPRD1OPRM1REN
SCHEMBL24183714 0.81 FAAH (0.53) PSMB5CTSBCHRNB2CHRNB4CHRNA3
SCHEMBL27109780 0.81 CHRNB2 (0.52) PSMB5CTSBCHRNB2CHRNB4CHRNA3

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-20240018159-A1 EXATECAN DERIVATIVES, LINKER-PAYLOADS, AND CONJUGATES AND THEREOF GENEQUANTUM HEALTHCARE (SUZHOU) CO., LTD. (CN) 2024-01-18 — — US disclosed
US-11814394-B2 Exatecan derivatives, linker-payloads, and conjugates and thereof GENEQUANTUM HEALTHCARE (SUZHOU) CO., LTD. (CN) 2023-11-14 — — US disclosed
US-20230271977-A1 EXATECAN DERIVATIVES, LINKER-PAYLOADS, AND CONJUGATES AND THEREOF GENEQUANTUM HEALTHCARE (SUZHOU) CO., LTD. (CN) 2023-08-31 — — 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 (3 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-20230271977-A1 EXATECAN DERIVATIVES, LINKER-PAYLOADS, AND CONJUGATES AND THEREOF XPOT, ENGASE, ENTPD8 PSMB5 2171/4885CTSB 2095/4885CHRNB2 2213/4885
US-11814394-B2 Exatecan derivatives, linker-payloads, and conjugates and thereof XPOT, ENGASE, ENTPD8 PSMB5 2171/4885CTSB 2095/4885CHRNB2 2213/4885
US-20240018159-A1 EXATECAN DERIVATIVES, LINKER-PAYLOADS, AND CONJUGATES AND THEREOF XPOT, ENGASE, ENTPD8 PSMB5 2171/4885CTSB 2095/4885CHRNB2 2213/4885

“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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