SCHEMBL27620147

SCHEMBL27620147

CNc1ccc2cc(N)cc(F)c2c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.38
EGFR P00533 2/20 0.34
MAPT P10636 2/20 0.34
APP P05067 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
SLC18A1 P54219 1/20 0.31
SLC18A2 Q05940 1/20 0.31
TERT O14746 1/20 0.31
PRMT7 Q9NVM4 4/20 0.31
KCNH2 Q12809 1/20 0.31
MET P08581 1/20 0.31
RXRA P19793 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL5514092 0.77 ALDH1A1 (0.44) MAPTESR1ESR2KCNH2TDP1
SCHEMBL18727213 0.76 PLAU (0.41) HTR6EGFRMAPTSLC18A1SLC18A2
SCHEMBL5513073 0.75 EGFR (0.34) HTR6EGFRAPPTERT
SCHEMBL5514136 0.75 SLC18A1 (0.34) SLC18A1SLC18A2TERTKCNH2RXRA
SCHEMBL27937836 0.74 KCNH2 (0.43) EGFRMAPTKCNH2MET
SCHEMBL23953164 0.72 ALDH1A1 (0.50) HTR6EGFRMAPTKCNH2TDP1
SCHEMBL5522364 0.72 ESR1 (0.59) ESR1ESR2
SCHEMBL5511618 0.71 MAPK14 (0.35) HTR6EGFRMAPTAPPESR1
SCHEMBL29242571 0.71 ALDH1A1 (0.48) HTR6EGFRMAPTKCNH2TDP1
SCHEMBL5507077 0.69 EGFR (0.35) HTR6EGFRMAPTAPPKCNH2

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-100478364-C Ethylene polymer and molded article obtained therefrom MITSUI CHEMICALS INC (JP) 2009-04-15 CN disclosed
CN-1732189-A Ethylene polymer and molded article obtained therefrom MITSUI CHEMICALS INC (JP) 2006-02-08 CN disclosed