SCHEMBL833371

SCHEMBL833371

Brc1ccnc(-c2cc(Br)ccn2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CCR1 P32246 3/20 0.48
CCR5 P51681 3/20 0.48
CCR8 P51685 3/20 0.48
RAD51 Q06609 1/20 0.41
SPR P35270 1/20 0.41
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
GRM5 P41594 2/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
METAP1 P53582 1/20 0.35
BLM P54132 1/20 0.35
HIF1A Q16665 1/20 0.35
DOHH Q9BU89 1/20 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
SCHEMBL30362730 0.97 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2CCR1CCR5
SCHEMBL308538 0.86 KDM4E (0.61) KDM4EALDH1A1SMN1; SMN2CCR1CCR5
SCHEMBL12176177 0.86 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2CCR1CCR5
SCHEMBL12893405 0.86 CCR1 (0.52) KDM4EALDH1A1SMN1; SMN2CCR1CCR5
SCHEMBL29218030 0.83 PTGS1 (0.41) KDM4EALDH1A1SMN1; SMN2CCR1CCR5
SCHEMBL16210551 0.83 MEN1 (0.47) KDM4EALDH1A1SMN1; SMN2PTGS1PTGS2
SCHEMBL4803 0.81 ASIC3 (0.59) KDM4EALDH1A1SMN1; SMN2GRM5LMNA
SCHEMBL5760081 0.81 SMN1; SMN2 (0.44) KDM4EALDH1A1SMN1; SMN2SPRPTGS1
SCHEMBL31645963 0.81 ASIC3 (0.59) KDM4EALDH1A1SMN1; SMN2GRM5LMNA
SCHEMBL28660470 0.81 RAD51 (0.37) KDM4EALDH1A1SMN1; SMN2CCR1CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122079873-A Dipyridyl iron complex, preparation method thereof and electrolyte 2026-05-26 CN claimed
CN-116606318-B Preparation method of phosphamide derivative 安阳师范学院 2025-05-27 CN claimed
CN-120006346-A Catalyst for electrochemical ammoxidation and preparation method thereof 大连理工大学 2025-05-16 CN claimed
CN-119746830-A Preparation method, adsorption and desorption method of lithium isotope adsorbent 中国科学院青海盐湖研究所 2025-04-04 CN claimed
CN-118388551-A Binuclear ruthenium complex and preparation method and application thereof 中山大学 2024-07-26 CN claimed
CN-116870962-A Multiphase nitrogen-containing ligand modified supported ruthenium catalyst and preparation and application thereof 中国科学院兰州化学物理研究所 2023-10-13 CN claimed
CN-116606318-A Preparation method of phosphamide derivative 安阳师范学院 2023-08-18 CN claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
CN-115869923-A Oxygen absorbing material, preparation method thereof and prepared adsorbing material capable of adsorbing oxygen and organic solvent simultaneously 威格科技(苏州)股份有限公司 2023-03-31 CN claimed
CN-115819472-A Polypyridine metal complex and preparation method thereof 广州大学 2023-03-21 CN claimed
CN-114456294-A Preparation method of organic porous material and application of organic porous material in preparation of ultra-high molecular weight polymer 合肥工业大学 2022-05-10 CN claimed
CN-108358970-A A kind of structure and preparation method of red emission ionic type iridium complex 昆明贵金属研究所 2018-08-03 CN claimed
CN-105131043-A Preparation and application of dipyridyl ruthenium dye with phenothiazine derivative as ligand UNIV SICHUAN 2015-12-09 CN claimed
US-12636366-B2 Ruthenium (II) complexes and conjugates thereof for use as photosensitizer agent in photodynamic therapy ECOLE NATIONALE SUPERIEURE DE CHIMIE DE PARIS (FR) 2026-05-26 US disclosed
CN-122079873-A Dipyridyl iron complex, preparation method thereof and electrolyte 2026-05-26 CN disclosed
WO-2026107178-A1 GLOBAL AFFINITY PROFILING OF MOLECULAR INTERACTIONS USING COMPETITIVE ENRICHMENT CORNELL UNIVERSITY (US) 2026-05-21 WO disclosed
WO-1995029924-A1 PHOSPHONATED POLYPYRIDYL COMPOUNDS AND THEIR COMPLEXES ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 1995-11-09 WO disclosed
EP-0360820-B1 OLIGOBIPYRIDINE LIGANDS, PROCESS FOR OBTAINING THEM AND APPLICATION AS COMPLEXING AGENTS CIS BIO INTERNATIONAL (FR) 1992-08-19 EP disclosed
EP-0360820-A1 OLIGOBIPYRIDINE LIGANDS, PROCESS FOR OBTAINING THEM AND APPLICATION AS COMPLEXING AGENTS. ORIS SA (FR) 1990-04-04 EP disclosed
WO-1988008419-A1 OLIGOBIPYRIDINE LIGANDS, PROCESS FOR OBTAINING THEM AND APPLICATION AS COMPLEXING AGENTS COMPAGNIE ORIS INDUSTRIE S.A. (FR) 1988-11-03 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 (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-12636366-B2 Ruthenium (II) complexes and conjugates thereof for use as photosensitizer agent in photodynamic therapy FABP2, APC, TP53 KDM4E 4759/4885ALDH1A1 2418/4885SMN1; SMN2 2206/4885

“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.