SCHEMBL674657

SCHEMBL674657

C1CNCCNCCCN(CCN2CCCNCCNCCCNCC2)CCNC1

nearest known ligand 0.83

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 14/20 0.83
MEN1 O00255 1/20 0.59
CHRM2 P08172 1/20 0.59
CHRM1 P11229 1/20 0.59
ADRA2C P18825 1/20 0.59
CCR2 P41597 1/20 0.59
CXCL12 P48061 1/20 0.59
BLM P54132 1/20 0.59
KMT2A Q03164 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
HRH3 Q9Y5N1 1/20 0.59
SIGMAR1 Q99720 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 1/20 0.46
RAD52 P43351 1/20 0.42
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL5573157 0.95 CXCR4 (0.74) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL23337601 0.95 CXCR4 (0.74) CXCR4MEN1CHRM2CHRM1ADRA2C
Hydrochloric Acid SCHEMBL5569544 0.92 CXCR4 (0.71) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL599000 0.91 CXCR4 (1.00) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL13661067 0.90 CXCR4 (0.68) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL9241446 0.88 CXCR4 (0.95) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL946201 0.87 CXCR4 (0.62) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL12992865 0.87 CXCR4 (0.62) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL12958880 0.87 CXCR4 (0.70) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL29352763 0.87 CXCR4 (0.70) CXCR4MEN1CHRM2CHRM1ADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210161859-A1 USE OF CXCR4 ANTAGONISTS University of Washington Center for Commercialization 2021-06-03 US claimed
US-20150030561-A1 Use of CXCR4 Antagonists GENZYME CORP. (US) 2015-01-29 US claimed
EP-2709991-A1 USE OF CXCR4 ANTAGONISTS Genzyme Corporation (US) 2014-03-26 EP claimed
WO-2012158707-A1 USE OF CXCR4 ANTAGONISTS GENZYME CORPORATION (US) 2012-11-22 WO claimed
EP-2391211-A1 METHODS AND COMPOSITIONS FOR TREATING BREAST CANCER Genzyme Corporation (US) 2011-12-07 EP claimed
US-20110280827-A1 METHODS AND COMPOSITIONS FOR TREATING HEMATOLOGICAL MALIGNANCIES HU YANPING (US) 2011-11-17 US claimed
US-20110281814-A1 METHODS AND COMPOSITIONS FOR TREATING BREAST CANCER GENZYME CORPORATION 2011-11-17 US claimed
EP-2384115-A1 METHODS AND COMPOSITIONS FOR TREATING HEMATOLOGICAL MALIGNANCIES Genzyme Corporation (US) 2011-11-09 EP claimed
EP-2371361-A1 Methods to mobilize progenitor/stem cells Genzyme Global S.à.r.l. (LU) 2011-10-05 EP claimed
US-7935692-B2 Methods to mobilize progenitor/stem cells GENZYME CORPORATION (US) 2011-05-03 US claimed
WO-2010088398-A1 METHODS AND COMPOSITIONS FOR TREATING HEMATOLOGICAL MALIGNANCIES GENZYME CORPORATION (US) 2010-08-05 WO claimed
WO-2010088401-A1 METHODS AND COMPOSITIONS FOR TREATING BREAST CANCER GENZYME CORPORATION (US) 2010-08-05 WO claimed
US-20100035941-A1 METHODS FOR INCREASING BLOOD FLOW AND/OR PROMOTING TISSUE REGENERATION GENZYME CORPORATION 2010-02-11 US claimed
US-6001826-A CONTAINING TWO TETRAAZACYCLOHEXADECANE, PENTAAZACYCLOHEAXDECANE, OR TETRAAZACYCLOTETRADECANE RINGS; ACTIVE AGAINST HIV-INFECTED CELLS ANORMED, INC. (CA) 1999-12-14 US claimed
WO-2025230907-A1 A CXCR4 ANTAGONIST, A STATS ACTIVATOR, AND/OR AN AGENT THAT INCREASES NITRIC OXIDE CONTENT FOR USE IN METHODS OF IMPROVING NERVE REGENERATION THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-11-06 WO disclosed
US-20250295698-A1 DOSING REGIMENS FOR THE MOBILIZATION OF HEMATOPOIETIC STEM CELLS ENSOMA INC (US) 2025-09-25 US disclosed
US-20250032549-A1 DOSING REGIMENS FOR THE MOBILIZATION OF HEMATOPOIETIC STEM AND PROGENITOR CELLS ENSOMA INC (US) 2025-01-30 US disclosed
US-20030130250-A1 Methods to mobilize progenitor/stem cells ANORMED, INC. (CA) 2003-07-10 US disclosed
US-6001826-A CONTAINING TWO TETRAAZACYCLOHEXADECANE, PENTAAZACYCLOHEAXDECANE, OR TETRAAZACYCLOTETRADECANE RINGS; ACTIVE AGAINST HIV-INFECTED CELLS ANORMED, INC. (CA) 1999-12-14 US disclosed
US-5021409-A Antiviral cyclic polyamines JOHNSON MATTHEY PLC (GB) 1991-06-04 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 (6 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-20210161859-A1 USE OF CXCR4 ANTAGONISTS CXCR4, CXCR2, CXCR3 CXCR4 1/4885MEN1 3707/4885CHRM2 1420/4885
US-20100035941-A1 METHODS FOR INCREASING BLOOD FLOW AND/OR PROMOTING TISSUE REGENERATION CCR2, CXCR4, CXCR2 CXCR4 2/4885MEN1 4046/4885CHRM2 600/4885
US-20250032549-A1 DOSING REGIMENS FOR THE MOBILIZATION OF HEMATOPOIETIC STEM AND PROGENITOR CELLS CXCL12, CD44, CD47 CXCR4 7/4885MEN1 1187/4885CHRM2 1312/4885
US-20150030561-A1 Use of CXCR4 Antagonists CXCR4, CXCR2, CXCR3 CXCR4 1/4885MEN1 3707/4885CHRM2 1420/4885
US-20030130250-A1 Methods to mobilize progenitor/stem cells CXCR4, CXCL12, CXCR2 CXCR4 1/4885MEN1 3350/4885CHRM2 748/4885
US-20250295698-A1 DOSING REGIMENS FOR THE MOBILIZATION OF HEMATOPOIETIC STEM CELLS CXCL12, CSF3R, THPO CXCR4 12/4885MEN1 185/4885CHRM2 3076/4885

“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.