SCHEMBL19092141

SCHEMBL19092141

CN(C)C1CCN([S+]([O-])c2ccc(I)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ L3MBTL3 Q96JM7 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL22837830 0.71 HTR2A (0.43) HTR2AHTR2CL3MBTL3L3MBTL1
SCHEMBL20598412 0.69 USP5 (0.56) HTR2AHTR2C
SCHEMBL18828725 0.68 L3MBTL3 (0.36) L3MBTL3L3MBTL1
SCHEMBL3780104 0.67 CYP1A2 (0.32) HTR2AHTR2CL3MBTL1
SCHEMBL578509 0.66 MCHR1 (0.48) HTR2AHTR2C
SCHEMBL578464 0.66 MCHR1 (0.48) HTR2AHTR2C
SCHEMBL2544388 0.66 MCHR1 (0.48) HTR2AHTR2C
SCHEMBL17271879 0.66 L3MBTL3 (0.84) L3MBTL3L3MBTL1
SCHEMBL3774487 0.65 ATM (0.36) HTR2AHTR2C
SCHEMBL23057104 0.64 HRH3 (0.31) —

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
WO-2017114497-A1 IMMUNE EFFECTOR CELL THERAPIES WITH ENHANCED EFFICACY NOVARTIS AG (CH) 2017-07-06 — — WO disclosed
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