SCHEMBL862114

SCHEMBL862114

c1c[nH]c(-c2ccc(-c3ccc(-c4ncc[nH]4)cc3)cc2)n1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.75
MTOR P42345 1/20 0.74
ADK P55263 1/20 0.74
ALDH1A1 P00352 4/20 0.64
KDM4E B2RXH2 2/20 0.64
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
CYP19A1 P11511 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
PDE3B Q13370 1/20 0.56
PDE3A Q14432 1/20 0.56
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL722191 0.97 NISCH (0.78) NISCHMTORADKALDH1A1KDM4E
SCHEMBL28823231 0.93 NISCH (0.67) NISCHMTORADKALDH1A1KDM4E
SCHEMBL5148367 0.91 NISCH (0.91) NISCHMTORADKALDH1A1KDM4E
SCHEMBL5914856 0.89 NISCH (0.62) NISCHMTORADKALDH1A1KDM4E
Biphenyl SCHEMBL7409338 0.88 NISCH (0.95) NISCHMTORADKALDH1A1KDM4E
SCHEMBL674010 0.86 NISCH (1.00) NISCHMTORADKALDH1A1KDM4E
SCHEMBL2464174 0.86 NISCH (0.64) NISCHMTORADKALDH1A1KDM4E
SCHEMBL771236 0.86 NISCH (0.64) NISCHMTORADKALDH1A1KDM4E
SCHEMBL22782678 0.86 NISCH (0.64) NISCHMTORADKALDH1A1KDM4E
SCHEMBL482165 0.86 NISCH (0.64) NISCHMTORADKALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350648-B Cobalt metal organic framework material and preparation method and application thereof 四川轻化工大学 2025-06-17 CN claimed
CN-119350648-A Cobalt metal organic framework material and preparation method and application thereof 四川轻化工大学 2025-01-24 CN claimed
CN-117024760-A Zinc transition metal coordination polymer and preparation method and application thereof 四川轻化工大学 2023-11-10 CN claimed
CN-119350648-B Cobalt metal organic framework material and preparation method and application thereof 四川轻化工大学 2025-06-17 CN disclosed
CN-119350648-B Cobalt metal organic framework material and preparation method and application thereof 四川轻化工大学 2025-06-17 CN disclosed
CN-119350648-A Cobalt metal organic framework material and preparation method and application thereof 四川轻化工大学 2025-01-24 CN disclosed
CN-119350648-A Cobalt metal organic framework material and preparation method and application thereof 四川轻化工大学 2025-01-24 CN disclosed
CN-117024760-A Zinc transition metal coordination polymer and preparation method and application thereof 四川轻化工大学 2023-11-10 CN disclosed
CN-111848651-A Copper complex with dye catalytic photodegradation property and preparation method thereof 盐城师范学院 2020-10-30 CN disclosed
CN-101998952-B Hepatitis c virus inhibitors BRISTOL-MYERS SQUIBB CO. (US) 2014-10-08 CN disclosed
JP-5314053-B2 2013-10-16 JP disclosed
EP-2250163-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-03-28 EP disclosed
CN-101998952-A Hepatitis c virus inhibitors BRISTOL MYERS SQUIBB CO 2011-03-30 CN disclosed
EP-2250163-A1 HEPATITIS C VIRUS INHIBITORS Bristol-Myers Squibb Company (US) 2010-11-17 EP disclosed
WO-2009102318-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-20 WO disclosed