SCHEMBL16100482

SCHEMBL16100482

[CH2]CN(C)Cc1nn(S(=O)(=O)c2ccccc2)c2ccc(O)cc12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 8/20 0.46
▸ ESR2 Q92731 2/20 0.37
▸ SRC P12931 2/20 0.34
▸ IDE P14735 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ LOXL2 Q9Y4K0 2/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ HTR1D P28221 1/20 0.33
▸ HTR1B P28222 1/20 0.33
▸ HTR1F P30939 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ SLC9A1 P19634 1/20 0.32
▸ CYTH2 Q99418 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
SCHEMBL17457576 0.85 HTR6 (0.45) HTR6ESR2IDEHTR1AHTR1D
SCHEMBL16120066 0.80 HTR6 (0.41) HTR6ALDH1A1
SCHEMBL16102368 0.78 HTR6 (0.43) HTR6ESR2SRCIDEHTR1A
SCHEMBL16099896 0.72 HTR6 (0.42) HTR6ESR2SRCESR1MEN1
SCHEMBL17457571 0.72 HTR6 (0.36) HTR6MEN1KMT2A
SCHEMBL17457568 0.69 MAPT (0.35) HTR6MEN1KMT2AALDH1A1
SCHEMBL3040501 0.63 IDE (0.55) HTR6IDEALDH1A1SLC9A1
SCHEMBL5504710 0.63 HTR6 (1.00) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL22915922 0.61 KLK7 (0.43) HTR6MEN1KMT2AALDH1A1SLC9A1
SCHEMBL19737377 0.61 HTR6 (0.59) HTR6HTR1AHTR1DHTR1BHTR1F

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-2970220-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-01-20 — — EP disclosed
WO-2014153235-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-09-25 — — WO disclosed
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