SCHEMBL1673295

SCHEMBL1673295

c1cc2nc(c1)CNCCNCCNC2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 5/20 0.56
APEX1 P27695 1/20 0.41
TERT O14746 2/20 0.41
ADRB1 P08588 3/20 0.39
HTR2A P28223 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
CYP1A2 P05177 1/20 0.39
HTR1A P08908 1/20 0.39
CYP2D6 P10635 1/20 0.39
NCF1 P14598 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
HTR7 P34969 1/20 0.39
MTOR P42345 1/20 0.39
HTR3A P46098 1/20 0.39
HTR5A P47898 1/20 0.39
HTR6 P50406 1/20 0.39

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
SCHEMBL8235408 1.00 CXCR4 (0.56) CXCR4APEX1TERTADRB1HTR2A
SCHEMBL29520740 1.00 CXCR4 (0.56) CXCR4APEX1TERTADRB1HTR2A
SCHEMBL9207672 0.97 CXCR4 (0.58) CXCR4APEX1TERTADRB1HTR2A
SCHEMBL20837979 0.91 CXCR4 (0.53) CXCR4APEX1TERTADRB1HTR2A
SCHEMBL29418138 0.88 CXCR4 (0.51) CXCR4APEX1TERTADRB1HTR2A
SCHEMBL13495066 0.87 CXCR4 (0.52) CXCR4ADRB1HTR2AHTR3EHTR3B
SCHEMBL31649015 0.86 CXCR4 (0.53) CXCR4ADRB1HTR2AHTR3EHTR3B
SCHEMBL14206482 0.82 CXCR4 (0.50) CXCR4APEX1ADRB1HTR2AHTR2C
SCHEMBL8260287 0.82 CXCR4 (0.43) CXCR4APEX1TERTADRB1HTR2A
SCHEMBL18312432 0.81 CXCR4 (0.49) CXCR4APEX1HTR2CKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4211146-B1 SYNTHETIC CYCLIC PEPTIDE MIMETICS UNIV BAR ILAN (IL) 2026-05-20 EP claimed
CN-122005879-A Modified GRPR antagonist peptides for cancer imaging and treatment 慕尼黑工业大学 2026-05-12 CN claimed
EP-4444709-B1 FAP-ALPHA SPECIFIC TUMOR DIAGNOSTIC IMAGING AGENT JIAXING PHARMADAX GENESIS PHARMACEUTICAL TECH CO LTD (CN) 2026-02-25 EP claimed
US-20250360218-A1 MITOCHONDRIA-TARGETING CANCER THERAPEUTIC COMPOSITION SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2025-11-27 US claimed
US-20250325718-A1 IMMUNOCONJUGATES COMPRISING KALLIKREIN RELATED PEPTIDASE 2 ANTIGEN BINDING DOMAINS AND THEIR USES JANSSEN BIOTECH INC (US) 2025-10-23 US claimed
WO-2025122363-A2 METHODS OF TREATING SMALL CELL LUNG CANCER Evergreen Discovery, LLC (US) 2025-06-12 WO claimed
US-20250186634-A1 METHODS OF TREATING SMALL CELL LUNG CANCER Evergreen Discovery, LLC (US) 2025-06-12 US claimed
WO-2025111445-A1 TROP-2 RADIOPHARMACEUTICAL CONJUGATE AND USES THEREOF CONVERGENT THERAPEUTICS, INC. (US) 2025-05-30 WO claimed
US-20250135047-A1 IMPROVED ALUMINUM FLUORIDE RADIOSYNTHESIS OF [18F]DK222 THE JOHNS HOPKINS UNIVERSITY 2025-05-01 US claimed
US-20250101475-A1 MONOOXYGENASE MUTANTS FOR BIOSYNTHESIS OF 2,6-BIS(HYDROXYMETHYL)PYRIDINE AND A METHOD FOR PREPARATION OF 2,6-BIS(HYDROXYMETHYL)PYRIDINE USING THE SAID MONOOXYGENASE MUTANTS VIO CHEMICALS AG (CH) 2025-03-27 US claimed
EP-3902800-B1 COMPLEX OF GADOLINIUM AND A CHELATING LIGAND DERIVED FROM A DIASTEREOISOMERICALLY ENRICHED PCTA AND PREPARATION AND PURIFICATION PROCESS GUERBET SA (FR) 2022-09-07 EP claimed
WO-2022174809-A1 ANTI-CLDN18.2 ANTIBODY CONJUGATES Suzhou Transcenta Therapeutics Co., Ltd. (CN) 2022-08-25 WO claimed
WO-2022162549-A2 IMMUNOCONJUGATES COMPRISING KALLIKREIN RELATED PEPTIDASE 2 ANTIGEN BINDING DOMAINS AND THEIR USES JANSSEN BIOTECH, INC. (US) 2022-08-04 WO claimed
EP-3902799-B1 COMPLEX OF GADOLINIUM AND A CHELATING LIGAND DERIVED OF A DIASTEREOISOMERICALLY ENRICHED PCTA AND SYNTHESIS METHOD GUERBET SA (FR) 2022-07-27 EP claimed
WO-2022032100-A2 IMAGING AND TARGETING PROGRAMMED DEATH LIGAND-1 (PD-LI) EXPRESSION THE JOHNS HOPKINS UNIVERSITY (US) 2022-02-10 WO claimed
US-20210196840-A1 GADOLINIUM BEARING PCTA-BASED CONTRAST AGENTS BRACCO IMAGING S.P.A. (IT) 2021-07-01 US claimed
EP-3770160-A1 GADOLINIUM BEARING PCTA-BASED CONTRAST AGENTS Bracco Imaging SPA (IT) 2021-01-27 EP claimed
EP-0698029-B1 PROCESS FOR THE PREPARATION OF AZAMACROCYLCIC OR ACYCLIC AMINOPHOSPHONATE ESTER DERIVATIVES DOW CHEMICAL CO (US) 1998-11-04 EP claimed
EP-0698029-A1 PROCESS FOR THE PREPARATION OF AZAMACROCYLCIC OR ACYCLIC AMINOPHOSPHONATE ESTER DERIVATIVES THE DOW CHEMICAL COMPANY (US) 1996-02-28 EP claimed
WO-1994026753-A1 PROCESS FOR THE PREPARATION OF AZAMACROCYLCIC OR ACYCLIC AMINOPHOSPHONATE ESTER DERIVATIVES THE DOW CHEMICAL COMPANY (US) 1994-11-24 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 (5 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-20250360218-A1 MITOCHONDRIA-TARGETING CANCER THERAPEUTIC COMPOSITION TSPO, TFAM, MCU CXCR4 2273/4885APEX1 2123/4885TERT 1663/4885
US-20250135047-A1 IMPROVED ALUMINUM FLUORIDE RADIOSYNTHESIS OF [18F]DK222 PDCD1LG2, CD274, PDCD1 CXCR4 684/4885APEX1 510/4885TERT 3718/4885
US-20210196840-A1 GADOLINIUM BEARING PCTA-BASED CONTRAST AGENTS GLRA1, GLRA2, GLRX3 CXCR4 2338/4885APEX1 2587/4885TERT 3400/4885
US-20250186634-A1 METHODS OF TREATING SMALL CELL LUNG CANCER SSTR2, CCKBR, GRPR CXCR4 460/4885APEX1 4480/4885TERT 1050/4885
US-20250325718-A1 IMMUNOCONJUGATES COMPRISING KALLIKREIN RELATED PEPTIDASE 2 ANTIGEN BINDING DOMAINS AND THEIR USES KLK3, KLK2, KLKB1 CXCR4 2755/4885APEX1 2478/4885TERT 4667/4885

“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.