SCHEMBL171399

SCHEMBL171399

CC[C@@H](N)CCCNC(=N)N

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALOX15 P16050 1/20 0.37
DPP7 Q9UHL4 2/20 0.34
NPY4R P50391 10/20 0.33
NPY1R P25929 7/20 0.33
NPY2R P49146 5/20 0.33
NPY5R Q15761 5/20 0.33
RRM1 P23921 1/20 0.32
TSHR P16473 1/20 0.31
HIF1A Q16665 1/20 0.31
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 1/20 0.30

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
SCHEMBL7158448 1.00 MEN1 (0.40) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL18822222 1.00 MEN1 (0.40) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL16138483 0.94 MEN1 (0.43) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL7877053 0.84 DPP7 (0.34) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL19368433 0.82 DPP7 (0.33) DPP7RRM1
SCHEMBL29404058 0.82 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL20822004 0.82 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL26614349 0.82 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL6545309 0.82 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL21973636 0.81 NPY4R (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2841084-B1 CXCR4 ANTAGONIST PEPTIDE FOR USE IN THE TREATMENT OF LARGE CELL LUNG CANCER BIOKINE THERAPEUTICS LTD (IL) 2018-05-30 EP disclosed
WO-2017075505-A2 NOVEL POLYPEPTIDES WITH IMPROVED PROTEOLYTIC STABILITY, AND METHODS OF PREPARING AND USING SAME TUFTS UNIVERSITY (US) 2017-05-04 WO disclosed
WO-2017075522-A2 GLP-2 POLYPEPTIDES WITH IMPROVED PROTEOLYTIC STABILITY, AND METHODS OF PREPARING AND USING SAME TUFTS UNIVERSITY (US) 2017-05-04 WO disclosed
US-9439942-B2 Peptides and use thereof in the treatment of large cell lung cancer BIOKINE THERAPEUTICS LTD. (IL) 2016-09-13 US disclosed
US-9439942-B2 Peptides and use thereof in the treatment of large cell lung cancer BIOKINE THERAPEUTICS LTD. (IL) 2016-09-13 US disclosed
US-9427456-B2 Peptide therapy for increasing platelet levels BIOKINE THERAPEUTICS LTD. (IL) 2016-08-30 US disclosed
US-9427456-B2 Peptide therapy for increasing platelet levels BIOKINE THERAPEUTICS LTD. (IL) 2016-08-30 US disclosed
EP-3011961-A1 4F-benzoyl-TN14003 for the mobilisation of hematopoietic progenitor cells in view of transplantation Biokine Therapeutics LTD. (IL) 2016-04-27 EP disclosed
US-9034814-B2 CXCR4 antagonists for wound healing and re-epithelialization HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2015-05-19 US disclosed
US-9034814-B2 CXCR4 antagonists for wound healing and re-epithelialization HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2015-05-19 US disclosed
US-20100143334-A1 T-140 PEPTIDE ANALOGS HAVING CXCR4 SUPER-AGONIST ACTIVITY FOR IMMUNOMODULATION BIOKINE THERAPEUTICS LTD. (IL) 2010-06-10 US disclosed
US-20100143334-A1 T-140 PEPTIDE ANALOGS HAVING CXCR4 SUPER-AGONIST ACTIVITY FOR IMMUNOMODULATION BIOKINE THERAPEUTICS LTD. (IL) 2010-06-10 US disclosed
US-20100055088-A1 CXCR4 Antagonists for Wound Healing and Re-Epithelialization HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2010-03-04 US disclosed
US-20100055088-A1 CXCR4 Antagonists for Wound Healing and Re-Epithelialization HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2010-03-04 US disclosed
US-20090181897-A1 CXCR4 ANTAGONIST AND USE THEREOF BIOKINE THERAPEUTICS LTD. (IL) 2009-07-16 US disclosed
US-20090181897-A1 CXCR4 ANTAGONIST AND USE THEREOF BIOKINE THERAPEUTICS LTD. (IL) 2009-07-16 US disclosed
US-7423007-B2 Cxcr4 antagonist and use thereof BIOKINE THERAPEUTICS LTD. (IL) 2008-09-09 US disclosed
US-7423007-B2 Cxcr4 antagonist and use thereof BIOKINE THERAPEUTICS LTD. (IL) 2008-09-09 US disclosed
WO-2008075369-A2 T-140 PEPTIDE ANALOGS HAVING CXCR4 SUPER-AGONIST ACTIVITY FOR BONE MARROW RECOVERY BIOKINE THERAPEUTICS LTD. (IL) 2008-06-26 WO disclosed
WO-2008075371-A2 T-140 PEPTIDE ANALOGS HAVING CXCR4 SUPER-AGONIST ACTIVITY FOR IMMUNOMODULATION BIOKINE THERAPEUTICS LTD. (IL) 2008-06-26 WO 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-20100055088-A1 CXCR4 Antagonists for Wound Healing and Re-Epithelialization CXCR4, CXCL12, CXCR5 MEN1 4364/4885CYP1A2 4821/4885KMT2A 4599/4885
US-20090181897-A1 CXCR4 ANTAGONIST AND USE THEREOF CXCR4, ACKR3, CXCR1 MEN1 2827/4885CYP1A2 4715/4885KMT2A 1987/4885
US-20100143334-A1 T-140 PEPTIDE ANALOGS HAVING CXCR4 SUPER-AGONIST ACTIVITY FOR IMMUNOMODULATION CXCR5, CXCR4, CXCR1 MEN1 2469/4885CYP1A2 4866/4885KMT2A 3038/4885

“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.