SCHEMBL29376182

SCHEMBL29376182

O=C(O)N1CC=Cc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 15/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
SCN4A P35499 1/20 0.43
SCN5A Q14524 1/20 0.43
SCN9A Q15858 1/20 0.43
P2RX1 P51575 6/20 0.41
P2RX3 P56373 6/20 0.41
P2RX7 Q99572 3/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B3 P37058 1/20 0.37
PTBP1 P26599 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL3375661 1.00 P2RX4 (0.44) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL3241414 0.86 P2RX4 (0.42) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL8705933 0.84 P2RX4 (0.57) P2RX4LMNATSHRMAPK1SCN4A
Indole SCHEMBL28214491 0.84 TRPA1 (0.45) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL1477941 0.84 NOTUM (0.46) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL1286806 0.84 LMNA (0.55) P2RX4LMNATSHRMAPK1SCN4A
Quinoline SCHEMBL28157604 0.83 ALDH1A1 (0.44) P2RX4LMNAMAPK1MEN1KMT2A
Isoquinoline SCHEMBL28075529 0.83 P2RX4 (0.38) P2RX4LMNATSHRMAPK1SCN4A
SCHEMBL7832555 0.82 P2RX4 (0.42) P2RX4LMNATSHRMAPK1SCN4A
Hydrochloric Acid SCHEMBL28145471 0.82 LMNA (0.53) P2RX4LMNATSHRMAPK1SCN4A

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113072553-B Preparation method and application of dehydrobufotenine 河北工业大学 2022-02-25 CN claimed
EP-4536656-A1 BICYCLIC-SUBSTITUTED GLUTARIMIDE CEREBLON BINDERS C4 Therapeutics, Inc. (US) 2025-04-16 EP disclosed
CN-114702544-B Amino steroid compound, and preparation method and application thereof 湖南科益新生物医药有限公司 2024-01-30 CN disclosed
WO-2024006379-A1 METHODS AND COMPOUNDS FOR INHIBITING MKK7 ENZYMES AXONIS THERAPEUTICS, INC. (US) 2024-01-04 WO disclosed
WO-2023239750-A1 BICYCLIC-SUBSTITUTED GLUTARIMIDE CEREBLON BINDERS C4 THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
EP-4243804-A1 SUBSTANCES FOR TREATMENT OF HYPERURICAEMIA ScandiBio Therapeutics AB (SE) 2023-09-20 EP disclosed
EP-4213831-A1 SUPPLEMENT FOR TREATMENT OF CORONAVIRUS INFECTION ScandiBio Therapeutics AB (SE) 2023-07-26 EP disclosed
EP-4192444-A1 AMINOACIDS FOR TREATMENT OF NEUROLOGICAL DISORDERS ScandiBio Therapeutics AB (SE) 2023-06-14 EP disclosed
CN-114041471-B Application of dehydrobufotenine 河北工业大学 2023-03-31 CN disclosed
CN-114702544-A Amino steroid compound and preparation method and application thereof 上海醇健实业发展有限公司 2022-07-05 CN disclosed
WO-2022123530-A1 BORONIC ACID COMPOUND 주식회사 엘지화학 2022-06-16 WO disclosed
WO-2022101501-A1 SUBSTANCES FOR TREATMENT OF HYPERURICAEMIA SCANDIBIO THERAPEUTICS AB (SE) 2022-05-19 WO disclosed
WO-2022063303-A1 A CLASS OF FUSED RING COMPOUNDS, AND PREPARATION AND USE THEREOF 石药集团中奇制药技术(石家庄)有限公司 2022-03-31 WO disclosed
WO-2022058026-A1 SUPPLEMENT FOR TREATMENT OF CORONAVIRUS INFECTION SCANDIBIO THERAPEUTICS AB (SE) 2022-03-24 WO disclosed
CN-113072553-B Preparation method and application of dehydrobufotenine 河北工业大学 2022-02-25 CN disclosed
CN-114044800-A Aryl, heteroaryl and heterocyclic compounds for the treatment of medical disorders 艾其林医药公司 2022-02-15 CN disclosed
CN-114041471-A Application of dehydrobufotenine 河北工业大学 2022-02-15 CN disclosed
WO-2022028678-A1 SUBSTANCES FOR TREATMENT OF NEUROLOGICAL DISORDERS SCANDIBIO THERAPEUTICS AB (SE) 2022-02-10 WO disclosed
WO-2022029184-A1 AMINOACIDS FOR TREATMENT OF NEUROLOGICAL DISORDERS SCANDIBIO THERAPEUTICS AB (SE) 2022-02-10 WO disclosed