SCHEMBL19957602

SCHEMBL19957602

CN(CC1CCNC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.49
USP30 Q70CQ3 1/20 0.49
HTR2B P41595 1/20 0.49
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A2 P23975 6/20 0.43
SLC6A4 P31645 6/20 0.43
CCR5 P51681 1/20 0.40
HTR2A P28223 1/20 0.40
KCNH2 Q12809 1/20 0.40
SLC6A3 Q01959 4/20 0.39
CYP2D6 P10635 3/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GBA1 P04062 2/20 0.39
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
HTR1D P28221 1/20 0.38

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
SCHEMBL34474144 0.83 HTR2C (0.47) HTR2CUSP30HTR2BMEN1ALDH1A1
SCHEMBL17303503 0.82 HTR2C (0.44) HTR2CUSP30HTR2BSLC6A2SLC6A4
SCHEMBL17300864 0.81 USP30 (0.43) HTR2CUSP30HTR2BSLC6A2SLC6A4
SCHEMBL17308354 0.81 USP30 (0.43) HTR2CUSP30HTR2BSLC6A2SLC6A4
SCHEMBL19287840 0.79 SLC6A2 (0.46) HTR2CUSP30HTR2BSLC6A2SLC6A4
SCHEMBL29455234 0.78 HTR2C (0.60) HTR2CHTR2BMEN1KMT2AHTR2A
SCHEMBL9833957 0.77 HTR2C (0.48) HTR2CHTR2BKDM4EMEN1ALDH1A1
SCHEMBL21456816 0.76 KMT2A (0.43) USP30KDM4EMEN1ALDH1A1KMT2A
SCHEMBL21139642 0.74 CCR5 (0.42) HTR2CHTR2BKDM4EMEN1ALDH1A1
SCHEMBL3485687 0.71 ALDH1A1 (0.71) HTR2CKDM4EMEN1ALDH1A1KMT2A

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-2935243-B1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF EPIZYME INC (US) 2018-03-14 EP disclosed