SCHEMBL28367152

SCHEMBL28367152

CCOc1ccc(-n2cnc3c[c]ccc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
FGFR1 P11362 6/20 0.44
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGS2 P35354 2/20 0.39
GSK3B P49841 1/20 0.39
SRC P12931 1/20 0.39
NQO1 P15559 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPK10 P53779 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
PTGS1 P23219 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL27933824 0.89 FGFR1 (0.57) HTTFGFR1ALDH1A1SMN1; SMN2MAPT
SCHEMBL28938202 0.86 HTT (0.64) HTTFGFR1ALDH1A1SMN1; SMN2MAPT
SCHEMBL695764 0.78 HCAR1 (0.44) HTTFGFR1MAPT
SCHEMBL694905 0.77 HTT (0.62) HTTFGFR1SRC
SCHEMBL15213044 0.76 GABRP (0.55) FGFR1ALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL701432 0.75 HPGD (0.45) HTTFGFR1ALDH1A1HPGDKDR
SCHEMBL15213068 0.75 FGFR1 (0.62) HTTFGFR1ALDH1A1SMN1; SMN2MAPT
SCHEMBL15213048 0.75 FGFR1 (0.53) HTTFGFR1ALDH1A1SMN1; SMN2MAPT
SCHEMBL16393877 0.74 FGFR1 (0.53) HTTFGFR1ALDH1A1SMN1; SMN2MAPT
SCHEMBL29623641 0.72 FGFR1 (0.75) FGFR1ALDH1A1SMN1; SMN2MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110698408-B Antiviral drug for treatment of arenavirus infection 奇尼塔病毒性出血热有限责任公司 2021-01-05 CN disclosed
CN-110776453-A Antiviral drug for treatment of arenavirus infection 奇尼塔四有限责任公司 2020-02-11 CN disclosed
CN-110698408-A Antiviral drug for treatment of arenavirus infection 奇尼塔四有限责任公司 2020-01-17 CN disclosed