SCHEMBL7922299

SCHEMBL7922299

O=C(CN(c1ccccc1)S(=O)(=O)C(F)(F)F)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.45
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
MLYCD O95822 1/20 0.41
NR1I2 O75469 1/20 0.41
MAPT P10636 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CES1 P23141 2/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 2/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 4/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL11607372 0.79 KDM4E (0.46) L3MBTL1CA12CA1CA2CA9
SCHEMBL11870700 0.76 MLYCD (0.48) L3MBTL1MLYCDMAPTTDP1KMT2A
SCHEMBL31614929 0.73 L3MBTL1 (0.39) L3MBTL1CA12CA2CA9NR1I2
SCHEMBL7123604 0.72 KEAP1 (0.46) L3MBTL1NR1I2SMN1; SMN2TSHR
SCHEMBL6204399 0.72 KEAP1 (0.67) CA12CA9MAPTKMT2AMEN1
SCHEMBL14855516 0.71 L3MBTL1 (0.47) L3MBTL1CA1CA2CA9KDM4E
SCHEMBL8042370 0.70 CES1 (0.42) L3MBTL1CA1CA2CA9MLYCD
SCHEMBL11754044 0.70 KDM4E (0.54) L3MBTL1MAPTTDP1KMT2AKDM4E
SCHEMBL20867667 0.69 HSD11B1 (0.53) L3MBTL1MAPTTDP1KMT2AKDM4E
SCHEMBL6202036 0.69 ADRA2C (0.57) L3MBTL1MAPTTDP1KMT2AKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2001527390-A 2001-12-25 JP claimed
EP-1011655-A1 INHIBITORS OF LEADERLESS PROTEIN EXPORT Ciblex Corporation (US) 2000-06-28 EP claimed
CN-1252716-A Inhibitors of leaderless protein export CIBLEX CORP (US) 2000-05-10 CN claimed
WO-1998037880-A1 INHIBITORS OF LEADERLESS PROTEIN EXPORT CIBLEX CORPORATION (US) 1998-09-03 WO claimed