SCHEMBL27917367

SCHEMBL27917367

CCCCc1cc(-c2ccccc2)nc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.58
SLC2A1 P11166 2/20 0.52
ACHE P22303 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ADORA3 P0DMS8 2/20 0.50
ADORA1 P30542 1/20 0.50
TLR8 Q9NR97 1/20 0.49
MOK Q9UQ07 1/20 0.48
TACR3 P29371 1/20 0.48

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
SCHEMBL9988793 0.95 DHODH (0.53) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL20414372 0.94 DHODH (0.52) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL27367367 0.84 ACHE (0.51) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL9179529 0.83 MEN1 (0.53) DHODHLMNAHPGDADORA3ADORA1
SCHEMBL13243228 0.83 ESRRB (0.59) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL8675109 0.83 ACHE (0.50) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL8091105 0.83 ACHE (0.54) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL27928277 0.82 MEN1 (0.52) DHODHHPGDTLR8
SCHEMBL20414364 0.81 ACHE (0.53) DHODHSLC2A1ACHELMNAHPGD
SCHEMBL28099203 0.80 DHODH (0.41) DHODHLMNAHPGDADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103012502-B Heteronuclear iridium gold bicyclo metal compound as well as preparation method and application of compound UNIV LUOYANG NORMAL 2014-12-03 CN disclosed
CN-103012502-A Heteronuclear iridium gold bicyclo metal compound as well as preparation method and application of compound UNIV LUOYANG NORMAL 2013-04-03 CN disclosed