SCHEMBL29899862

SCHEMBL29899862

O=[N+]([O-])c1cccc(Br)c1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.70
LMNA P02545 2/20 0.70
ALDH1A1 P00352 6/20 0.57
ACHE P22303 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
ALOX15 P16050 1/20 0.57
HSP90AA1 P07900 1/20 0.55
GAA P10253 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
TP53 P04637 1/20 0.52
NFE2L2 Q16236 2/20 0.50
TRPV1 Q8NER1 1/20 0.50
KEAP1 Q14145 1/20 0.50
CA2 P00918 1/20 0.50
CA5A P35218 1/20 0.50

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
SCHEMBL85551 1.00 TSHR (0.70) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL25435523 1.00 TSHR (0.70) TSHRLMNAALDH1A1ACHETDP1
Fluoride SCHEMBL6141214 0.98 TSHR (0.67) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL27950091 0.98 TSHR (0.67) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL19025580 0.98 TSHR (0.67) TSHRLMNAALDH1A1ACHETDP1
Ammonia Solution, Strong SCHEMBL27659899 0.98 TSHR (0.67) TSHRLMNAALDH1A1ACHETDP1
Bromide SCHEMBL4031266 0.98 TSHR (0.67) TSHRLMNAALDH1A1ACHETDP1
Ethane SCHEMBL991925 0.96 TSHR (0.64) TSHRLMNAALDH1A1ACHETDP1
Formaldehyde SCHEMBL27686649 0.96 TSHR (0.64) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL28053869 0.90 TSHR (0.57) TSHRLMNAALDH1A1ACHETDP1

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
EP-4562016-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 EP disclosed
EP-4539849-A1 COMPOUNDS FOR THE TARGETED DEGRADATION OF SMARCA2 C4 Therapeutics, Inc. (US) 2025-04-23 EP disclosed
EP-4519246-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PRIDOPIDINE Prilenia Neurotherapeutics Ltd. (IL) 2025-03-12 EP disclosed
WO-2024227104-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BRAF VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS, INC. (US) 2024-10-31 WO disclosed
EP-4426289-A1 AKT3 MODULATORS Georgiamune Inc. (US) 2024-09-11 EP disclosed
CN-118076593-A 3CLpro protease inhibitors 上海齐鲁制药研究中心有限公司 2024-05-24 CN disclosed
EP-4367113-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS Biogen MA Inc. (US) 2024-05-15 EP disclosed
WO-2024059808-A1 WEE1 INHIBITORS AND METHODS FOR TREATING CANCER RECURIUM IP HOLDINGS, LLC (US) 2024-03-21 WO disclosed
WO-2024026483-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2023244764-A1 COMPOUNDS FOR THE TARGETED DEGRADATION OF SMARCA2 C4 THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed
WO-2023214412-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PRIDOPIDINE PRILENIA NEUROTHERAPEUTICS LTD. (IL) 2023-11-09 WO disclosed
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis GALAPAGOS NV (BE) 2023-08-08 US disclosed
CN-112384517-B Heteroaryl compounds and uses thereof 新旭生技股份有限公司 2023-07-14 CN disclosed
WO-2023081845-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 WO disclosed
CN-114929690-B Novel heterocyclic derivatives having cardiomyocyte proliferative activity for the treatment of heart disease 同济大学 2023-05-05 CN disclosed
EP-4146666-A1 AKT3 MODULATORS Georgiamune LLC (US) 2023-03-15 EP disclosed
EP-4146185-A1 AKT3 MODULATORS Georgiamune LLC (US) 2023-03-15 EP disclosed
WO-2023283610-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS BIOGEN MA INC. (US) 2023-01-12 WO disclosed
CN-114929690-A Novel heterocyclic derivatives with cardiomyocyte proliferative activity for the treatment of cardiac diseases 同济大学 2022-08-19 CN 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 (1 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-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis ADAMTS1, ADAMTS5, ADAMTS7 TSHR 3353/4885LMNA 868/4885ALDH1A1 441/4885

“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.