SCHEMBL19901978

SCHEMBL19901978

COCN1CC(OC(=O)c2cccc3ccc(C(CC(C)C)C(C)C)cc23)CN(COC)C1=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 4/20 0.33
HTR3B O95264 4/20 0.33
HTR3A P46098 4/20 0.33
HTR3D Q70Z44 4/20 0.33
HTR3C Q8WXA8 4/20 0.33
LGALS9 O00182 1/20 0.32
LGALS1 P09382 1/20 0.32
LGALS3 P17931 1/20 0.32
LGALS7; LGALS7B P47929 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
SCHEMBL10053070 0.86 HDAC4 (0.33) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL19901944 0.85 HTR3E (0.38) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL19901945 0.83 POLB (0.33)
SCHEMBL19901950 0.80 HTR3A (0.32) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10053086 0.80 TP53 (0.31) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10053080 0.80 TP53 (0.31) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10053071 0.79 HDAC4 (0.33) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL19901949 0.76 RAB9A (0.40)
SCHEMBL10053075 0.73 HTR3E (0.35) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL20109662 0.72 POLB (0.34)

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