SCHEMBL9113377

SCHEMBL9113377

[CH2]C=CC1OCc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.33
SLC6A4 P31645 11/20 0.33
CYP2D6 P10635 8/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTR2A P28223 2/20 0.32
SLC6A3 Q01959 3/20 0.32
NISCH Q9Y2I1 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL28612853 0.82 PRCP (0.37) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL2653892 0.78 SLC6A2 (0.34) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL27754818 0.77 SLC6A2 (0.33) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL27415175 0.74 HTR2A (0.39) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL5083201 0.71 SLC6A2 (0.37) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL11419089 0.71 SLC6A2 (0.37) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL24999225 0.67 MAOA (0.41) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL3420534 0.67 MAOA (0.41) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL22731139 0.67 HTR2A (0.37) SLC6A2SLC6A4CYP2D6NPC1RAB9A
SCHEMBL18536393 0.67 HTR2A (0.37) SLC6A2SLC6A4CYP2D6NPC1RAB9A

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
EP-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed