SCHEMBL185325

SCHEMBL185325

N#Cc1cccc(F)c1Br

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 1/20 0.39
TSHR P16473 1/20 0.38
TRPV4 Q9HBA0 2/20 0.38
LMNA P02545 1/20 0.37
DYRK1A Q13627 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CUL4A Q13619 1/20 0.35
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
MCL1 Q07820 1/20 0.33
KAT6A Q92794 1/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL30151887 1.00 BCAT1 (0.39) BCAT1TSHRTRPV4LMNADYRK1A
SCHEMBL832 0.83 TSHR (0.46) TSHRLMNADYRK1AESR2CA1
SCHEMBL16958809 0.77 CES2 (0.30)
SCHEMBL31032883 0.76 DYRK1A (0.47) TSHRLMNADYRK1AESR2CA1
SCHEMBL30443847 0.76 BCAT1 (0.49) BCAT1TSHRTRPV4CA1CA2
SCHEMBL3386194 0.76 DYRK1A (0.47) TSHRLMNADYRK1AESR2CA1
SCHEMBL158537 0.76 BCAT1 (0.49) BCAT1TSHRTRPV4CA1CA2
Water SCHEMBL28049227 0.76 BCAT1 (0.49) BCAT1TSHRTRPV4CA1CA2
SCHEMBL100446 0.75
SCHEMBL30489137 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027031-A Carbonyl ring-closed arylamine fluorescent compound with narrow band emission, and preparation method and application thereof 广东工业大学 2024-05-14 CN claimed
CN-115745974-A Chiral near ultraviolet organic electroluminescent material, preparation method thereof and application thereof in CP-OLED 华南理工大学 2023-03-07 CN claimed
EP-3688116-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-06 EP claimed
EP-3672956-B1 ORGANIC TRIAZINE CONTAINING MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-06-02 EP claimed
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 US claimed
EP-3688116-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-08-05 EP claimed
EP-3672956-A1 ORGANIC TRIAZINE CONTAINING MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-01 EP claimed
EP-3266772-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-24 EP claimed
WO-2019063288-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELCTRONIC DEVICES CYNORA GMBH (DE) 2019-04-04 WO claimed
CN-109553567-A Organic molecule, especially for the organic molecule in opto-electronic device 辛诺拉有限公司 2019-04-02 CN claimed
CN-109422674-A Organic molecule is especially used for the organic molecule of opto-electronic device 辛诺拉有限公司 2019-03-05 CN claimed
WO-2019038448-A1 ORGANIC TRIAZINE CONTAINING MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-02-28 WO claimed
EP-3433239-B1 SMALL MOLECULE INHIBITORS OF THE NUCLEAR TRANSLOCATION OF ANDROGEN RECEPTOR FOR THE TREATMENT OF CASTRATION-RESISTANT PROSTATE CANCER UNIV PITTSBURGH COMMONWEALTH SYS HIGHER EDUCATION (US) 2026-05-27 EP disclosed
CN-117024411-B Isoquinoline as HPK1 inhibitor 豪夫迈·罗氏有限公司 2026-05-19 CN disclosed
EP-4720044-A1 AROMATIC AMIDES AND CONJUGATES THEREOF AS BINDERS TO TEAD Beactica Therapeutics AB (SE) 2026-04-08 EP disclosed
EP-4121421-B1 BIARYL DERIVATIVES AS YAP/TAZ-TEAD PROTEIN-PROTEIN INTERACTION INHIBITORS NOVARTIS AG (CH) 2026-03-11 EP disclosed
US-20020193385-A1 Imidazo-pyrimidine derivatives as ligands for gaba receptors MERCK SHARP & DOHME (UK) LIMITED (GB) 2002-12-19 US disclosed
WO-2002074772-A1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2002-09-26 WO disclosed
WO-2002074773-A1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2002-09-26 WO disclosed
WO-2002038568-A1 IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2002-05-16 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 (2 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-20020193385-A1 Imidazo-pyrimidine derivatives as ligands for gaba receptors GABRA3, GABRA1, GABRA2 BCAT1 193/4885TSHR 240/4885TRPV4 1861/4885
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 BCAT1 4099/4885TSHR 3378/4885TRPV4 145/4885

“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.