SCHEMBL19901950

SCHEMBL19901950

COCN1CC(OC(=O)c2c(C(CC(C)C)C(C)C)ccc3ccccc23)CN(COC)C1=O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 4/20 0.32
HTR3E A5X5Y0 3/20 0.32
HTR3B O95264 3/20 0.32
HTR3D Q70Z44 3/20 0.32
HTR3C Q8WXA8 3/20 0.32
HCRTR1 O43613 4/20 0.31
HCRTR2 O43614 4/20 0.31
PSMB1 P20618 1/20 0.31
PSMB5 P28074 1/20 0.31
ALDH1A1 P00352 1/20 0.30
PTGER3 P43115 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
SCHEMBL10053073 0.86 ALDH1A1 (0.33) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL10053078 0.78 HTR3E (0.30) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL10053079 0.73 ALDH1A1 (0.34) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL10053085 0.70 HTR3E (0.38) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL19901949 0.69 RAB9A (0.40) ALDH1A1
SCHEMBL10053064 0.69 MEN1 (0.35) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL20109663 0.67 POLB (0.46) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL10053075 0.67 HTR3E (0.35) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL20109662 0.66 POLB (0.34)
SCHEMBL10053071 0.65 HDAC4 (0.33) HTR3AHTR3EHTR3BHTR3DHTR3C

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
US-9904168-B2 Actinic ray-sensitive or radiation-sensitive resin composition, actinic ray-sensitive or radiation-sensitive film, mask blank provided with actinic ray-sensitive or radiation-sensitive film, pattern forming method, method for manufacturing electronic device, and electronic device FUJIFILM CORPORATION (JP) 2018-02-27 US disclosed