SCHEMBL29625234

SCHEMBL29625234

O=[N+]([O-])c1ccc2c(c1)Sc1cc([N+](=O)[O-])ccc1N2

nearest known ligand 0.84

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SNCA P37840 10/20 0.84
NOX1 Q9Y5S8 1/20 0.68
CAPN9 O14815 1/20 0.50
CASP3 P42574 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
CYP3A4 P08684 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL1208092 1.00 SNCA (0.84) SNCANOX1CAPN9CASP3MEN1
SCHEMBL29214094 0.93 SNCA (0.79) SNCANOX1CAPN9CASP3MEN1
SCHEMBL30867073 0.93 SNCA (0.79) SNCANOX1CAPN9CASP3MEN1
SCHEMBL14571431 0.92 SNCA (0.72) SNCANOX1CAPN9CASP3MEN1
Dimethyl Sulfoxide SCHEMBL18398818 0.92 SNCA (0.72) SNCANOX1CAPN9CASP3MEN1
SCHEMBL239724 0.92 SNCA (1.00) SNCANOX1MEN1KMT2ANPC1
SCHEMBL30769632 0.92 SNCA (1.00) SNCANOX1MEN1KMT2ANPC1
SCHEMBL26017582 0.90 SNCA (0.70) SNCANOX1CAPN9CASP3MEN1
SCHEMBL13210525 0.90 SNCA (0.70) SNCANOX1CAPN9CASP3MEN1
SCHEMBL8226190 0.87 SNCA (0.67) SNCANOX1CAPN9CASP3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447421-A Synthesis method of 3, 7-bis- (dimethylamino) -phenothiazine 上海沃凯生物技术有限公司 2024-01-26 CN claimed
EP-4543863-A1 FERROPTOSIS INHIBITORS AND USES THEREOF University Of Ottawa (CA) 2025-04-30 EP disclosed
CN-119695218-A N-heterocyclic aromatic compound-containing aqueous organic flow battery 中国科学院大连化学物理研究所 2025-03-25 CN disclosed
CN-118271309-A Electrochromic compound, preparation method thereof, electrochromic composition, electrochromic device and electronic equipment 比亚迪股份有限公司 2024-07-02 CN disclosed
CN-117447421-A Synthesis method of 3, 7-bis- (dimethylamino) -phenothiazine 上海沃凯生物技术有限公司 2024-01-26 CN disclosed
WO-2023245297-A1 FERROPTOSIS INHIBITORS AND USES THEREOF UNIVERSITY OF OTTAWA (CA) 2023-12-28 WO disclosed
CN-104606199-B 3, 7-diamino-10H-phenothiazine compound salt and use thereof 维斯塔实验室有限公司 2022-09-13 CN disclosed
CN-107848992-B Method for chemically synthesizing substituted 10H-phenothiazine-3, 7-diamine compound 维斯塔实验室有限公司 2022-05-31 CN disclosed
CN-114478432-A Phenothiazine long-life organic room-temperature phosphorescent material containing halogenated alkyl chain and synthesis and application thereof 陕西师范大学 2022-05-13 CN disclosed