SCHEMBL28085639

SCHEMBL28085639

Cc1cc2ccccc2nc1-c1ccc(F)cc1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.74
MBNL1 Q9NR56 1/20 0.61
MAPK14 Q16539 7/20 0.53
MAPK10 P53779 2/20 0.53
PDK1 Q15118 6/20 0.53
TDP1 Q9NUW8 2/20 0.49
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
STAT3 P40763 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ADORA2A P29274 1/20 0.45

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
SCHEMBL14341084 0.86 PDE10A (0.79) PDE10AMBNL1PDK1TDP1POLB
SCHEMBL14341086 0.86 PDE10A (0.93) PDE10AMBNL1PDK1TDP1LMNA
SCHEMBL2125225 0.85 PDE10A (1.00) PDE10AMBNL1PDK1TDP1LMNA
SCHEMBL6858227 0.84 PDE10A (0.96) PDE10AMBNL1PDK1TDP1LMNA
SCHEMBL30999690 0.84 PDE10A (0.96) PDE10AMBNL1PDK1TDP1LMNA
SCHEMBL27610987 0.84 PDE10A (0.96) PDE10AMBNL1PDK1TDP1LMNA
SCHEMBL28531479 0.83 PDE10A (0.70) PDE10AMBNL1MAPK14PDK1TDP1
SCHEMBL8735820 0.83 PDE10A (0.65) PDE10AMBNL1MAPK14PDK1TDP1
SCHEMBL28853907 0.83 PDE10A (0.74) PDE10AMBNL1MAPK14PDK1TDP1
SCHEMBL12970154 0.83 PDE10A (0.74) PDE10AMBNL1PDK1TDP1STAT3

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-112521333-A Synthesis method of chiral 2, 3-disubstituted tetrahydroquinoline derivative 中国科学院大连化学物理研究所 2021-03-19 CN disclosed
CN-105801630-A Organometallic complex, and light-emitting element and light-emitting device using the organometallic complex 株式会社半导体能源研究所 2016-07-27 CN disclosed