SCHEMBL9026316

SCHEMBL9026316

c1c[nH]c(-c2nc(-c3ncc[nH]3)nc(-c3ncc[nH]3)n2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.50
MTOR P42345 1/20 0.50
ADK P55263 1/20 0.50
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
ADRA2A P08913 3/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
SMPD3 Q9NY59 1/20 0.38
ADRA2B P18089 2/20 0.38
ADRA2C P18825 2/20 0.38
CSNK1A1 P48729 1/20 0.37
TYRO3 Q06418 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
CYP1A2 P05177 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
SCHEMBL4554721 0.84 NISCH (0.42) NISCHMTORADKALDH1A1KDM4E
SCHEMBL13977589 0.83 NISCH (0.50) NISCHMTORADKALDH1A1KDM4E
SCHEMBL8538483 0.83 ADORA2A (0.50) NISCHMTORADKALDH1A1KDM4E
SCHEMBL81650 0.82 NISCH (0.59) NISCHMTORADKALDH1A1KDM4E
SCHEMBL5192498 0.82 NISCH (0.41) NISCHMTORADKALDH1A1KDM4E
SCHEMBL5672220 0.82 NISCH (0.41) NISCHMTORADKALDH1A1KDM4E
SCHEMBL87466 0.81 NISCH (0.54) NISCHMTORADKALDH1A1KDM4E
SCHEMBL28425230 0.79 NISCH (0.56) NISCHMTORADKALDH1A1KDM4E
Hydrochloric Acid SCHEMBL1536214 0.79 NISCH (0.56) NISCHMTORADKALDH1A1KDM4E
Hydrochloric Acid SCHEMBL3069705 0.79 NISCH (0.52) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110790926-B Preparation method and application of palladium-containing metal-polycarbocarbene porous organic polymer 中南大学 2020-08-25 CN claimed
CN-110790926-A Preparation method and application of palladium-containing metal-polycarbocarbene porous organic polymer 中南大学 2020-02-14 CN claimed
CN-110790926-B Preparation method and application of palladium-containing metal-polycarbocarbene porous organic polymer 中南大学 2020-08-25 CN disclosed
CN-110790926-A Preparation method and application of palladium-containing metal-polycarbocarbene porous organic polymer 中南大学 2020-02-14 CN disclosed
EP-0576393-B1 Curable compositions based on epoxy resins or mixtures of epoxy resins and polyisocyanates containing a trisimidazolyltriazone CIBA GEIGY AG (CH) 1996-04-10 EP disclosed
EP-0576393-A1 Curable compositions based on epoxy resins or mixtures of epoxy resins and polyisocyanates containing a trisimidazolyltriazone CIBA-GEIGY AG (CH) 1993-12-29 EP disclosed