SCHEMBL17351900

SCHEMBL17351900

NC(N)=NCc1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 4/20 0.52
GRIN1 Q05586 3/20 0.52
GRIN2D O15399 2/20 0.52
GRIN3B O60391 2/20 0.52
GRIN2A Q12879 2/20 0.52
GRIN2C Q14957 2/20 0.52
GRIN3A Q8TCU5 2/20 0.52
F11 P03951 1/20 0.47
HTR3E A5X5Y0 1/20 0.47
HTR3B O95264 1/20 0.47
HTR3A P46098 1/20 0.47
HTR3D Q70Z44 1/20 0.47
HTR3C Q8WXA8 1/20 0.47
MIF P14174 1/20 0.47
SLC22A2 O15244 1/20 0.46
SLC22A1 O15245 1/20 0.46
SLC22A3 O75751 1/20 0.46
PLAU P00749 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.46
TAAR1 Q96RJ0 3/20 0.46

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
Hydrochloric Acid SCHEMBL27636313 0.98 GRIN2B (0.55) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL1737052 0.88 GRIN1 (0.62) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
Sulfuric Acid SCHEMBL11883316 0.86 F2 (0.46) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7635935 0.79 GRIN1 (0.54) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL4094076 0.79 GRIN2D (0.54) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL3916736 0.78 HTR3A (0.66) GRIN2BGRIN1F11HTR3EHTR3B
SCHEMBL14764459 0.78 GRIN1 (0.48) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL4097844 0.77 GRIN2D (0.52) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL9667523 0.77 TAAR1 (0.71) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL45769 0.76 GRIN2B (0.68) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A

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-119350192-A Phenoxyalkyl guanidine derivative of targeting norepinephrine transporter as well as preparation method and application thereof 四川大学华西医院 2025-01-24 CN disclosed
EP-2948188-B1 NEURONAL IMAGING AND TREATMENT TYLERTON INT HOLDINGS INC (VG) 2021-09-08 EP disclosed
US-20150366523-A1 NEURONAL IMAGING AND TREATMENT TYLERTON INTERNATIONAL HOLDINGS INC. (VG) 2015-12-24 US disclosed