SCHEMBL6726735

SCHEMBL6726735

O=C(Oc1c(F)c(F)cc(F)c1F)c1ccc([18F])nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 1/20 0.41
▸ KCNQ2 O43526 1/20 0.41
▸ CHIT1 Q13231 1/20 0.39
▸ CHIA Q9BZP6 1/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MAOB P27338 1/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SLC2A1 P11166 1/20 0.35
▸ SLC2A4 P14672 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ MAPT P10636 2/20 0.35

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
SCHEMBL416586 1.00 KCNQ3 (0.41) KCNQ3KCNQ2CHIT1CHIAMAPK1
SCHEMBL29525674 1.00 KCNQ3 (0.41) KCNQ3KCNQ2CHIT1CHIAMAPK1
SCHEMBL15247100 0.91 KCNQ3 (0.38) KCNQ3KCNQ2CHIT1CHIAMAPK1
SCHEMBL19816909 0.86 MAPK1 (0.53) MAPK1KDM4EL3MBTL1MAOBHDAC3
SCHEMBL6726742 0.86 KMT2A (0.50) KCNQ3KCNQ2MAPK1KDM4EL3MBTL1
SCHEMBL29815064 0.85 NAPRT (0.47) KCNQ3KCNQ2L3MBTL1NPC1RAB9A
SCHEMBL19360803 0.85 MAPK1 (0.37) MAPK1KDM4EL3MBTL1MAOBHDAC3
SCHEMBL10001386 0.85 NAPRT (0.47) KCNQ3KCNQ2L3MBTL1NPC1RAB9A
SCHEMBL17544977 0.84 ALOX5AP (0.41) MAPK1KDM4EL3MBTL1MAOBHDAC3
SCHEMBL30563841 0.83 KCNQ3 (0.43) KCNQ3KCNQ2CHIT1CHIAMAPK1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388523-A1 18F-LABELED PEPTIDE LIGANDS USEFUL IN PET AND CERENKOV LUMINESCENE IMAGING CORNELL UNIVERSITY (US) 2025-12-25 — — US disclosed
US-12297157-B2 18F-labeled peptide ligands useful in PET and Cerenkov luminescene imaging CORNELL UNIVERSITY (US) 2025-05-13 — — US disclosed
US-12016936-B2 Neovascular-targeting contrast medium composition and method for preparing same KOREA BASIC SCIENCE INSTITUTE (KR) 2024-06-25 — — US disclosed
EP-4249005-A2 18F-LABELED TRIAZOLE CONTAINING PSMA INHIBITORS Cornell University (US) 2023-09-27 — — EP disclosed
US-20230271923-A1 IMAGING AND TARGETING PROGRAMMED DEATH LIGAND-1 (PD-LI) EXPRESSION THE JOHNS HOPKINS UNIVERSTY 2023-08-31 — — US disclosed
EP-3493856-B1 18F-LABELED TRIAZOLE CONTAINING PSMA INHIBITORS UNIV CORNELL (US) 2023-08-09 — — EP disclosed
US-20220194904-A1 18F-LABELED TRIAZOLE CONTAINING PSMA INHIBITORS CORNELL UNIVERSITY (US) 2022-06-23 — — US disclosed
WO-2018048856-A1 METHOD FOR EFFICIENT RADIOLABELING OF BIOMOLECULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-03-15 — — WO disclosed
US-20130251632-A1 APOPTOSIS PET IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2013-09-26 — — US disclosed
US-8530620-B2 Radiolabelling reagents and methods GE HEALTHCARE LIMITED (GB) 2013-09-10 — — US disclosed
US-20120121509-A1 VITAL FLUOROCHROME CONJUGATES AND METHODS OF USE THE GENERAL HOSPITAL CORPORATION (US) 2012-05-17 — — US disclosed
US-20120022227-A1 RADIOLABELLING REAGENTS AND METHODS GE HEALTHCARE LIMITED (GB) 2012-01-26 — — US disclosed
US-20110142760-A1 PSMA-BINDING AGENTS AND USES THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 — — 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 (9 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-20110142760-A1 PSMA-BINDING AGENTS AND USES THEREOF KLK3, FOLH1, DNPEP KCNQ3 3231/4885KCNQ2 2397/4885CHIT1 2912/4885
US-12016936-B2 Neovascular-targeting contrast medium composition and method for preparing same ITGAV, VCAM1, ITGB3 KCNQ3 1683/4885KCNQ2 2635/4885CHIT1 2387/4885
US-20250388523-A1 18F-LABELED PEPTIDE LIGANDS USEFUL IN PET AND CERENKOV LUMINESCENE IMAGING SCTR, SSTR3, SSTR1 KCNQ3 787/4885KCNQ2 1467/4885CHIT1 1052/4885
US-20120121509-A1 VITAL FLUOROCHROME CONJUGATES AND METHODS OF USE CASP3, CASP7, CD47 KCNQ3 2999/4885KCNQ2 3413/4885CHIT1 2108/4885
US-20230271923-A1 IMAGING AND TARGETING PROGRAMMED DEATH LIGAND-1 (PD-LI) EXPRESSION CD274, PDCD1LG2, PDCD1 KCNQ3 4749/4885KCNQ2 4774/4885CHIT1 701/4885
US-12297157-B2 18F-labeled peptide ligands useful in PET and Cerenkov luminescene imaging VIP, CALCA, GLP1R KCNQ3 2483/4885KCNQ2 2503/4885CHIT1 477/4885
US-20130251632-A1 APOPTOSIS PET IMAGING AGENTS BAX, CASP3, PHOSPHO1 KCNQ3 2219/4885KCNQ2 2616/4885CHIT1 4080/4885
US-20120022227-A1 RADIOLABELLING REAGENTS AND METHODS ANPEP, DNPEP, QRFPR KCNQ3 2450/4885KCNQ2 2854/4885CHIT1 1989/4885
US-20220194904-A1 18F-LABELED TRIAZOLE CONTAINING PSMA INHIBITORS PSMA3, FOLH1, PSMA1 KCNQ3 2022/4885KCNQ2 3151/4885CHIT1 2147/4885

“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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