SCHEMBL29419035

SCHEMBL29419035

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
SCHEMBL40547 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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122080080-A Binuclear iridium metal conjugate, water-soluble nanoparticle, preparation method and application thereof in ultrasonic thrombolysis 2026-05-26 CN claimed
CN-120040517-A Preparation method and application of aggregation-induced emission iridium complex 大连理工大学 2025-05-27 CN claimed
CN-119893869-A Precise AMB ceramic circuit board and preparation method thereof 江苏富乐华半导体科技股份有限公司 2025-04-25 CN claimed
CN-119192124-A Preparation method of 3, 4-benzocoumarin compound 新疆农业大学 2024-12-27 CN claimed
CN-119013558-A Photoactivated antibody conjugates 新析生物科技股份有限公司 2024-11-22 CN claimed
CN-116284145-B Preparation of light release ruthenium complex and application of light release ruthenium complex in resisting drug-resistant tumors 中山大学·深圳 2024-11-15 CN claimed
CN-118895517-A Bioelectrochemistry driven CO of artificial coenzyme2Three-chamber electrolytic cell device for producing formic acid by reduction and electrolytic method 淮阴师范学院 2024-11-05 CN claimed
CN-118878388-A Synthesis method of quinazoline and heterocyclic compound promoted by near infrared light 中国科学院大学 2024-11-01 CN claimed
CN-118388552-A Deuterated binuclear iridium complex and preparation method and application thereof 中山大学 2024-07-26 CN 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
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
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-122080080-A Binuclear iridium metal conjugate, water-soluble nanoparticle, preparation method and application thereof in ultrasonic thrombolysis 2026-05-26 CN disclosed
CN-109863145-B Novel tetrahydroisoquinoline and tetrahydronaphthyridine compounds for the treatment and prevention of hepatitis b virus infection 豪夫迈·罗氏有限公司 2022-04-12 CN disclosed
CN-110256489-B Preparation method of alkyl phosphonyl 苏州大学 2022-03-08 CN disclosed