SCHEMBL21722665

SCHEMBL21722665

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1Br)C(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.52
CTSK P43235 6/20 0.52
AAK1 Q2M2I8 7/20 0.48
CTSB P07858 2/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
TACR1 P25103 2/20 0.43
CACNA1B Q00975 1/20 0.43
ACE P12821 1/20 0.41
KLK5 Q9Y337 1/20 0.41
CTSL P07711 1/20 0.40

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
SCHEMBL21732907 1.00 CTSS (0.52) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL21722664 1.00 CTSS (0.52) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL18179194 0.89 AAK1 (0.51) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL18179185 0.88 CTSS (0.49) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL26372576 0.88 CTSS (0.50) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL18170221 0.88 AAK1 (0.52) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL18170254 0.88 AAK1 (0.54) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL28340282 0.88 AAK1 (0.52) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL17258264 0.84 AAK1 (0.44) CTSSCTSKAAK1CTSBALDH1A1
SCHEMBL17258263 0.84 AAK1 (0.44) CTSSCTSKAAK1CTSBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12331067-B2 Method for preparing 18F-BPA and intermediate NEUBORON MEDTECH LTD. (CN) 2025-06-17 US disclosed
CN-112979684-B Preparation 18 F-BPA process 南京江原安迪科正电子研究发展有限公司 2023-11-03 CN disclosed
EP-3838890-B1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE NEUBORON MEDTECH LTD (CN) 2023-10-04 EP disclosed
US-20230242555-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE NEUBORON MEDTECH LTD. (CN) 2023-08-03 US disclosed
US-20230242555-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE NEUBORON MEDTECH LTD. (CN) 2023-08-03 US disclosed
US-20230242555-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE NEUBORON MEDTECH LTD. (CN) 2023-08-03 US disclosed
US-11655261-B2 Method for preparing 18F-BPA and intermediate NEUBORON MEDTECH LTD. (CN) 2023-05-23 US disclosed
US-11655261-B2 Method for preparing 18F-BPA and intermediate NEUBORON MEDTECH LTD. (CN) 2023-05-23 US disclosed
US-11655261-B2 Method for preparing 18F-BPA and intermediate NEUBORON MEDTECH LTD. (CN) 2023-05-23 US disclosed
CN-110835310-B Intermediate, preparation method and application 南京中硼联康医疗科技有限公司 2022-09-20 CN disclosed
CN-110835352-B Preparation method18Process for F-BPA 南京中硼联康医疗科技有限公司 2022-05-24 CN disclosed
CN-113773337-A Radiolabeled boron-containing compounds, methods of preparation and uses 南京中硼联康医疗科技有限公司 2021-12-10 CN disclosed
US-20210230192-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE NEUBORON MEDTECH LTD. (CN) 2021-07-29 US disclosed
CN-113045592-A 18Process for the preparation of F-BPA 南京江原安迪科正电子研究发展有限公司 2021-06-29 CN disclosed
EP-3838890-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE Neuboron Medtech Ltd. (CN) 2021-06-23 EP disclosed
CN-112979684-A Preparation of18Process for F-BPA 南京江原安迪科正电子研究发展有限公司 2021-06-18 CN disclosed
CN-110835352-A Preparation method18Process for F-BPA 南京中硼联康医疗科技有限公司 2020-02-25 CN disclosed
CN-110835310-A Intermediate, preparation method and application 南京中硼联康医疗科技有限公司 2020-02-25 CN disclosed
WO-2020035011-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE 南京中硼联康医疗科技有限公司 2020-02-20 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 (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-20230242555-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE CYP19A1, SHBG, ESR1 CTSS 1606/4885CTSK 1792/4885AAK1 2159/4885
US-12331067-B2 Method for preparing 18F-BPA and intermediate CYP19A1, SHBG, ESR1 CTSS 1606/4885CTSK 1792/4885AAK1 2159/4885
US-20210230192-A1 METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE CYP19A1, SHBG, ESR1 CTSS 1606/4885CTSK 1792/4885AAK1 2159/4885
US-11655261-B2 Method for preparing 18F-BPA and intermediate CYP19A1, SHBG, ESR1 CTSS 1606/4885CTSK 1792/4885AAK1 2159/4885

“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.