SCHEMBL16709180

SCHEMBL16709180

C[C@@H]1N(C)c2cccnc2N1CCN1c2ncccc2N(C)[C@@H]1C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ KMT2A Q03164 4/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ ADRA2A P08913 1/20 0.32
▸ ADRA2B P18089 1/20 0.32
▸ ADRA2C P18825 1/20 0.32
▸ PTPN2 P17706 1/20 0.32
▸ PTPN1 P18031 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDM1A O60341 1/20 0.30
▸ DRD2 P14416 1/20 0.30

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
SCHEMBL16709166 0.91 KDM4E (0.38) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16709181 0.86 ADORA3 (0.36) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16722857 0.83 KDM4E (0.47) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL26275270 0.83 KDM4E (0.47) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL32662296 0.83 KDM4E (0.47) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL23059124 0.82 KDM4E (0.39) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL18019561 0.81 KDM4E (0.31) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL16709147 0.81 ADORA3 (0.35) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL22370039 0.76 KDM4E (0.37) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL23059121 0.75 ADORA3 (0.36) KDM4EALDH1A1GAAHPGDALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9306179-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-04-05 — — US disclosed
US-9306179-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-04-05 — — US disclosed
US-20150129840-A1 OSMIUM COMPLEXES COMPRISING THREE DIFFERENT BIDENTATE LIGANDS AND METHOD OF MAKING THE SAME UNIVERSAL DISPLAY CORPORATION (US) 2015-05-14 — — US disclosed
US-20150129840-A1 OSMIUM COMPLEXES COMPRISING THREE DIFFERENT BIDENTATE LIGANDS AND METHOD OF MAKING THE SAME UNIVERSAL DISPLAY CORPORATION (US) 2015-05-14 — — US disclosed
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