SCHEMBL11207790

SCHEMBL11207790

CN1CCC(OC(=O)C(c2noc3ccc(Cl)cc23)C2CCCCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 3/20 0.39
HTR2A P28223 1/20 0.38
DRD3 P35462 1/20 0.38
HTR1A P08908 1/20 0.38
FAAH O00519 1/20 0.38
FNTA P49354 2/20 0.37
FNTB P49356 2/20 0.37
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
CSNK1A1 P48729 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HTR3A P46098 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
Oxalic Acid SCHEMBL11210539 0.97 HTR1F (0.38) HTR1FHTR2ADRD3HTR1AFAAH
SCHEMBL11209018 0.86 HIF1A (0.42) KMT2AMEN1ALDH1A1MAPTTSHR
SCHEMBL11207375 0.85 SLC6A3 (0.50) HTR2ADRD3FAAHSLC6A3
SCHEMBL11211029 0.83 FAAH (0.41) FAAHKMT2ASLC6A3HTR3A
Bromide SCHEMBL10923172 0.74 MAPT (0.46) HTR1FHTR2ADRD3HTR1AFAAH
SCHEMBL11207995 0.73 HIF1A (0.43) KMT2AMEN1TSHR
SCHEMBL10920458 0.71 MEN1 (0.40) HTR2AKMT2AMEN1ALDH1A1MAPT
SCHEMBL10919126 0.71 MEN1 (0.40) HTR2AKMT2AMEN1ALDH1A1MAPT
SCHEMBL7271094 0.71 FAAH (0.47) HTR2ADRD3FAAHHTR3A
Hydrochloric Acid SCHEMBL7271028 0.70 FAAH (0.46) HTR2ADRD3FAAHHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0094833-A2 Novel 1,2-benzisoxazole derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1983-11-23 EP disclosed