SCHEMBL557234

SCHEMBL557234

Brc1cnc2c(ccc3cc(Br)cnc32)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.52
CCR5 P51681 3/20 0.52
CCR8 P51685 3/20 0.52
HTT P42858 4/20 0.41
KMT2A Q03164 2/20 0.41
DYRK1A Q13627 6/20 0.41
CYP2A6 P11509 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
NOS1 P29475 2/20 0.35
METAP2 P50579 2/20 0.35
CSNK2A1 P68400 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
BACE1 P56817 1/20 0.35
AURKA O14965 2/20 0.35
JAK2 O60674 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
SCHEMBL29407003 1.00 CCR1 (0.52) CCR1CCR5CCR8HTTKMT2A
SCHEMBL28864557 0.93 CCR1 (0.46) CCR1CCR5CCR8HTTKMT2A
SCHEMBL29442917 0.91 CCR1 (0.45) CCR1CCR5CCR8HTTKMT2A
SCHEMBL28864558 0.91 CCR1 (0.45) CCR1CCR5CCR8HTTKMT2A
SCHEMBL31252050 0.87 CCR1 (0.42) CCR1CCR5CCR8HTTKMT2A
SCHEMBL913400 0.85 CCR1 (0.62) CCR1CCR5CCR8HTTKMT2A
SCHEMBL29473294 0.85 CCR1 (0.62) CCR1CCR5CCR8HTTKMT2A
Hydrochloric Acid SCHEMBL30950693 0.84 CCR1 (0.61) CCR1CCR5CCR8HTTKMT2A
SCHEMBL29853619 0.84 CCR1 (0.39) CCR1CCR5CCR8HTTKMT2A
SCHEMBL26104501 0.84 CCR1 (0.39) CCR1CCR5CCR8HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12351548-B2 Method for preparing carbonyl sulfone SOOCHOW UNIVERSITY (CN) 2025-07-08 US claimed
WO-2025043152-A1 METHODS OF DEALKENYLATIVE AMINATION AND AZIDATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-02-27 WO claimed
CN-117317259-B Preparation method and application of conjugated microporous polymer-based Fe-N-C catalyst 兰州理工大学 2024-06-11 CN claimed
CN-118165288-A Continuous microfluidic channel synthesis method of hydrogen production catalyst 山东金德新材料有限公司 2024-06-11 CN claimed
CN-118005935-A Method for preparing Phen-based organic porous framework/Ni/Fe salt hybrid material 三峡大学 2024-05-10 CN claimed
CN-117753385-A Covalent organic framework material machine for xenon and nitrogen separation and preparation method and application thereof 西安交通大学 2024-03-26 CN claimed
CN-117603233-A Zinc complex and preparation method and application thereof 深圳大学 2024-02-27 CN claimed
CN-117486941-A Rhenium complex with aggregation-induced emission characteristic, and preparation method and application thereof 深圳大学 2024-02-02 CN claimed
CN-117317259-A Preparation method and application of conjugated microporous polymer-based Fe-N-C catalyst 兰州理工大学 2023-12-29 CN claimed
CN-117024354-B Preparation method of Rui Mi Buti Ni 天津凯莱英制药有限公司 2023-12-08 CN claimed
WO-2021104503-A1 METHOD FOR PREPARING CARBONYL SULFONE 苏州大学 2021-06-03 WO claimed
CN-111072654-B Water-phase heavy metal chelating agent and preparation method thereof 南京艾姆材料科技有限公司 2021-03-16 CN claimed
CN-112442085-A Asymmetrically substituted phenanthroline-based organic electron transport material, and preparation and application thereof 华南理工大学 2021-03-05 CN claimed
CN-110385137-B Heterogeneous nano carbon-based catalyst, preparation method thereof and application thereof in ethylbenzene oxidation 中国科学技术大学 2020-12-25 CN claimed
CN-111718381-A Osmium metal organic compound containing polypyridine ligand and preparation method and application thereof 荆楚理工学院 2020-09-29 CN claimed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN claimed
CN-111072654-A Water-phase efficient heavy metal chelating agent and preparation method thereof 南京艾姆材料科技有限公司 2020-04-28 CN claimed
CN-110818600-A Method for preparing β -carbonyl sulfone 苏州大学 2020-02-21 CN claimed
CN-104892598-A A 1,10-fenanthrolin derivative, a preparing method thereof and applications of the derivative UNIV NANJING INF SCI & TECH 2015-09-09 CN claimed
CN-104672237-A Organic photosensitive dye based on phenanthroline as electron acceptor as well as preparation method and application of organic photosensitive dye CHINESE ACAD INST CHEMISTRY 2015-06-03 CN 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 (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-12351548-B2 Method for preparing carbonyl sulfone TST, CBS, STS CCR1 3677/4885CCR5 4160/4885CCR8 4540/4885

“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.