SCHEMBL40547

SCHEMBL40547

Brc1ccc(-c2ccccn2)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.61
LMNA P02545 3/20 0.61
CCR1 P32246 3/20 0.61
CCR5 P51681 3/20 0.61
CCR8 P51685 3/20 0.61
P4HTM Q9NXG6 3/20 0.61
CYP1A2 P05177 1/20 0.61
POLB P06746 1/20 0.61
METAP1 P53582 1/20 0.61
BLM P54132 1/20 0.61
HIF1A Q16665 1/20 0.61
DOHH Q9BU89 1/20 0.61
NPC1 O15118 5/20 0.58
TP53 P04637 4/20 0.58
RAB9A P51151 4/20 0.58
ALOX15 P16050 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
HTT P42858 2/20 0.58
ALDH1A1 P00352 1/20 0.58

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
SCHEMBL29419035 1.00 KDM4E (0.61) KDM4ELMNACCR1CCR5CCR8
SCHEMBL3348890 0.91 KDM4E (0.64) KDM4ELMNACCR1CCR5CCR8
SCHEMBL646630 0.87 CYP2A6 (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL23331923 0.84 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL23082001 0.83 CCR1 (0.47) KDM4ELMNACCR1CCR5CCR8
SCHEMBL40864 0.83 KDM4E (0.46) KDM4ECCR1CCR5CCR8P4HTM
SCHEMBL31500786 0.80 CCR1 (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL8739165 0.80 CCR1 (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL163378 0.79 KDM4E (0.78) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL3711450 0.78 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250362307-A1 PHOTOACTIVE ANTIBODY CONJUGATE LIAO JUNG CHI (TW) 2025-11-27 US claimed
WO-2025132825-A1 1H-IMIDAZO[4,5-C]QUINOLINE METAL-BASED COMPLEXES USEFUL AS MEDICAMENTS FUNDACIÓN DONOSTIA INTERNATIONAL PHYSICS CENTER - DIPC (ES) 2025-06-26 WO claimed
EP-4473309-A1 PHOTOACTIVE ANTIBODY CONJUGATE Syncell (Taiwan) Inc. (TW) 2024-12-11 EP claimed
CN-117924171-A Phenanthrone derivative and synthesis method thereof 华南理工大学 2024-04-26 CN claimed
CN-117776958-A Aromatic hydrocarbon carboxylic acid meta-position alkylation product and synthesis method thereof 华南理工大学 2024-03-29 CN claimed
CN-117343106-A Iridium complex, preparation method thereof and application thereof in resisting cerebral neuroma 中山大学 2024-01-05 CN claimed
CN-116144034-B Metal triangle supermolecule with near infrared fluorescence, preparation method and application thereof 广州大学 2023-11-24 CN claimed
WO-2023196986-A1 PHOTOACTIVE ANTIBODY CONJUGATE Syncell (Taiwan) Inc. (TW) 2023-10-12 WO claimed
CN-116284145-A Preparation of light release ruthenium complex and application of light release ruthenium complex in resisting drug-resistant tumors 中山大学·深圳 2023-06-23 CN claimed
CN-113663733-B Preparation and application of graphene covalent supported bipyridine metal complex catalyst 合肥工业大学 2023-06-06 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-116144034-A Metal triangle supermolecule with near infrared fluorescence, preparation method and application thereof 广州大学 2023-05-23 CN claimed
CN-115925752-A Near-infrared light-releasing binuclear ruthenium complex, preparation thereof and application thereof in resisting non-small cell lung cancer drug resistance 中山大学·深圳 2023-04-07 CN claimed
CN-113663733-A Preparation and application of graphene covalent load bipyridine metal complex catalyst 合肥工业大学 2021-11-19 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-105968126-A Dipyridine/phenanthroline onium salt-containing water/alcohol-soluble conjugated micromolecule and preparation method and application thereof 华南理工大学 2016-09-28 CN claimed
CN-116917271-B Process for producing arylthiol ester compound AGC株式会社 2026-05-15 CN disclosed
US-20250362307-A1 PHOTOACTIVE ANTIBODY CONJUGATE LIAO JUNG CHI (TW) 2025-11-27 US disclosed
US-20020034658-A1 Organic electroluminescent device comprising dipyridylthiophene derivative CHISSO CORPORATION (JP) 2002-03-21 US disclosed
EP-1186605-A1 Organic electroluminescent device comprising dipyridylthiophene derivative CHISSO CORPORATION (JP) 2002-03-13 EP 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-20020034658-A1 Organic electroluminescent device comprising dipyridylthiophene derivative LAGE3, MAL2, ELF3 KDM4E 276/4885LMNA 2640/4885CCR1 545/4885

“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.