SCHEMBL457067

SCHEMBL457067

CC(C)NCCCC[C@H](N)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.53
ARG2 P78540 4/20 0.48
ARG1 P05089 3/20 0.48
NOS2 P35228 5/20 0.47
NOS1 P29475 4/20 0.47
NOS3 P29474 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
NOD1 Q9Y239 1/20 0.47
BLM P54132 1/20 0.46
DDAH1 O94760 1/20 0.45
MEN1 O00255 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
OTC P00480 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
SCHEMBL1932144 1.00 GSR (0.53) GSRARG2ARG1NOS2NOS1
SCHEMBL3727819 1.00 GSR (0.53) GSRARG2ARG1NOS2NOS1
SCHEMBL14844417 0.94 GSR (0.50) GSRARG2ARG1NOS2NOS1
SCHEMBL8709636 0.94 GSR (0.50) GSRARG2ARG1NOS2NOS1
SCHEMBL18741586 0.94 GSR (0.50) GSRARG2ARG1NOS2NOS1
SCHEMBL28025400 0.89 GSR (0.53) GSRARG2ARG1NOS2NOS1
SCHEMBL9974063 0.87 GSR (0.52) GSRARG2ARG1NOS2NOS1
SCHEMBL21068053 0.87 GSR (0.52) GSRARG2ARG1NOS2NOS1
SCHEMBL187909 0.87 GSR (0.52) GSRARG2ARG1NOS2NOS1
SCHEMBL25406097 0.86 SLC1A3 (0.46) GSRCYP1A2BLMKMT2A

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 676 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12616761-B2 CXCR4-targeting compounds THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2026-05-05 US claimed
US-20250242064-A1 CXCR4-TARGETING COMPOUNDS, AND METHODS OF MAKING AND USING THE SAME ALPHA-9 ONCOLOGY INC. (CA) 2025-07-31 US claimed
WO-2025147774-A1 COMPOSITIONS TARGETING BRADYKININ RECEPTOR B1 FOR MEDICAL IMAGING AND TREATMENT OF CANCER AND OTHER DISORDERS ALPHA-9 ONCOLOGY INC. (CA) 2025-07-17 WO claimed
US-20250222146-A1 Radiopharmaceuticals Targeting Somatostatin Receptor 2 and Uses Thereof RAYZEBIO, INC. (US) 2025-07-10 US claimed
WO-2025137441-A1 RADIOPHARMACEUTICALS TARGETING SOMATOSTATIN RECEPTOR 2 AND USES THEREOF RAYZEBIO, INC. (US) 2025-06-26 WO claimed
WO-2025137443-A1 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING SOMATOSTATIN RECEPTORS AND USES THEREOF RAYZEBIO, INC. (US) 2025-06-26 WO claimed
WO-2025068346-A1 PHARMACEUTICAL COMBINATION OF CXCR4, PD-1 AND FAK INHIBITORS FOR TREATING CANCER SPEXIS AG (CH) 2025-04-03 WO claimed
WO-2025068348-A1 PHARMACEUTICAL COMBINATION OF CXCR4 AND PD-1 INHIBITORS FOR TREATING CANCER SPEXIS AG (CH) 2025-04-03 WO claimed
EP-4511384-A1 CXCR4-TARGETING COMPOUNDS, AND METHODS OF MAKING AND USING THE SAME Provincial Health Services Authority (CA) 2025-02-26 EP claimed
US-20240342321-A1 NOVEL CXCR4-TARGETING COMPOUNDS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2024-10-17 US claimed
WO-2022106061-A1 PHARMACEUTICAL COMBINATIONS COMPRISING A PEPTIDE CXCR4 INHIBITOR AND A TAXANE FOR TREATING CANCER POLYPHOR AG (CH) 2022-05-27 WO claimed
EP-4000613-A1 PHARMACEUTICAL COMBINATIONS COMPRISING A PEPTIDE CXCR4 INHIBITOR AND A TAXANE FOR TREATING CANCER Polyphor Ag (CH) 2022-05-25 EP claimed
WO-2022082312-A1 NOVEL CXCR4-TARGETING COMPOUNDS PROVINCIAL HEALTH SERVICES AUTHORITY (CA) 2022-04-28 WO claimed
WO-2022028737-A1 ANTIMICROBIAL PEPTIDOMIMETICS POLYPHOR AG (CH) 2022-02-10 WO claimed
US-5516887-A Luteinizing hormone releasing hormone antagonist peptides Deghenghi, Romano (CH) 1996-05-14 US claimed
EP-0540676-B1 PEPTIDE COMPOUNDS HAVING GROWTH HORMONE RELEASING ACTIVITY POLYGEN HOLDING CORP (US) 1994-11-17 EP claimed
EP-0434675-B1 POLYPEPTIDE COMPOUNDS HAVING GROWTH HORMONE RELEASING ACTIVITY POLYGEN HOLDING CORPORATION (US) 1993-09-01 EP claimed
EP-0434675-A1 POLYPEPTIDE COMPOUNDS HAVING GROWTH HORMONE RELEASING ACTIVITY. EASTMAN KODAK CO (US) 1991-07-03 EP claimed
US-4851385-A LUTEINIZING HORMONE RELEASING HORMONE INDIANA UNIVERSITY FOUNDATION (US) 1989-07-25 US claimed
WO-1988009780-A2 POLYPEPTIDE COMPOUNDS HAVING GROWTH HORMONE RELEASING ACTIVITY EASTMAN KODAK COMPANY (US) 1988-12-15 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20250242064-A1 CXCR4-TARGETING COMPOUNDS, AND METHODS OF MAKING AND USING THE SAME CXCR4, CXCL12, ACKR3 GSR 4799/4885ARG2 1514/4885ARG1 807/4885
US-20240342321-A1 NOVEL CXCR4-TARGETING COMPOUNDS CXCR4, CXCL12, CXCR2 GSR 4629/4885ARG2 1805/4885ARG1 1228/4885
US-12616761-B2 CXCR4-targeting compounds CXCR4, CXCR2, CXCR3 GSR 4046/4885ARG2 415/4885ARG1 149/4885
US-20250222146-A1 Radiopharmaceuticals Targeting Somatostatin Receptor 2 and Uses Thereof SSTR2, SSTR4, SSTR5 GSR 2461/4885ARG2 505/4885ARG1 517/4885

“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.