SCHEMBL4916622

SCHEMBL4916622

C=C1CC=CN=C1c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.43
LMNA P02545 3/20 0.43
CCR1 P32246 3/20 0.43
CCR5 P51681 3/20 0.43
CCR8 P51685 3/20 0.43
CYP1A2 P05177 2/20 0.43
POLB P06746 1/20 0.43
METAP1 P53582 1/20 0.43
BLM P54132 1/20 0.43
HIF1A Q16665 1/20 0.43
DOHH Q9BU89 1/20 0.43
P4HTM Q9NXG6 1/20 0.43
NPC1 O15118 6/20 0.38
TP53 P04637 5/20 0.38
RAB9A P51151 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
ALOX15 P16050 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
HTT P42858 2/20 0.38

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
Fluoride SCHEMBL29494146 0.98 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29494142 0.98 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
Bromide SCHEMBL28338946 0.98 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
Hydrochloric Acid SCHEMBL29188241 0.98 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL28628525 0.98 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
Hydrochloric Acid SCHEMBL28598655 0.98 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30362597 0.79 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29809937 0.79 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8
SCHEMBL812421 0.79 KDM4E (0.43) KDM4ELMNACCR1CCR5CCR8
SCHEMBL3751912 0.79 KDM4E (0.43) 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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116102032-A Preparation method of ZSM-5 molecular sieve 淄博恒亿化工科技有限公司 2023-05-12 CN claimed
CN-116102031-A ZSM-5 molecular sieve, preparation method and application thereof in catalyzing cyclohexene hydration reaction 淄博恒亿化工科技有限公司 2023-05-12 CN claimed
WO-2022242584-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS 清华大学 2022-11-24 WO claimed
CN-114914508-A Application of porous membrane in neutral water system organic flow battery 宿迁时代储能科技有限公司 2022-08-16 CN claimed
CN-109232567-B Tetrachlorocopper-bipyridyl quaternary ammonium salt and preparation method and application thereof 华南农业大学 2019-12-20 CN claimed
CN-119859163-A Preparation method of 4-substituted furanose derivative 中山大学 2025-04-22 CN disclosed
CN-118203582-A Application of Liproxstatin-1 in preparation of medicine for preventing and treating organ failure caused by diquat poisoning 福建医科大学附属第一医院 2024-06-18 CN disclosed
CN-118121572-A Application of vitamin K in preparation of medicine for preventing and treating organ failure caused by diquat poisoning 福建医科大学附属第一医院 2024-06-04 CN disclosed
CN-117859742-A Cationic herbicide capable of slowing down passivation in soil and preparation method and application thereof 华南农业大学 2024-04-12 CN disclosed
CN-117820315-A Preparation method of 1,1 '-ethylene-2, 2' -bipyridine dichloride 南阳理工学院 2024-04-05 CN disclosed
CN-116903620-A Synthesis method of diquat dichloride 安徽红太阳生物化学有限公司 2023-10-20 CN disclosed
CN-116574188-A Antibodies against diquat and uses thereof 重庆艾生斯生物工程有限公司 2023-08-11 CN disclosed
CN-113437229-B Organic electroluminescent device and display device 清华大学 2022-04-01 CN disclosed
CN-113437229-A Organic electroluminescent device and display device 清华大学 2021-09-24 CN disclosed
CN-113437229-A Organic electroluminescent device and display device 清华大学 2021-09-24 CN disclosed
CN-111574605-A Application of rice gene OsLAT5 in regulation of absorption and accumulation of diquat 华南农业大学 2020-08-25 CN disclosed
CN-107573342-B Preparation method of 1,1 '-ethylene-2, 2' -bipyridyl dichloride salt 南京红太阳生物化学有限责任公司 2020-06-16 CN disclosed
US-20080269065-A1 Conformationally Constrained Analytical Probes SYNTRIX BIOSYSTEMS, INC. (US) 2008-10-30 US disclosed
US-5410020-A Complexing; forming an exchange-inert complex with polypeptide THE SCRIPPS RESEARCH INSTITUTE (US) 1995-04-25 US disclosed
US-5200504-A Coordination complexes THE SCRIPPS RESEARCH INSTITUTE (US) 1993-04-06 US disclosed