SCHEMBL24254539

SCHEMBL24254539

Cc1ccc(SN(C)C)cc1NC(=O)Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
KCNQ2 O43526 1/20 0.49
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GAA P10253 1/20 0.47
MAPK8 P45983 1/20 0.46
PARP14 Q460N5 1/20 0.46
RXFP1 Q9HBX9 1/20 0.45
CSNK1D P48730 1/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
RIPK1 Q13546 1/20 0.43
CTSD P07339 1/20 0.43
PDE5A O76074 1/20 0.43
SMYD3 Q9H7B4 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42

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
SCHEMBL24254523 0.84 HPGD (0.59) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL24254501 0.80 CTSD (0.62) MAPTMEN1KMT2AKCNQ2KDM4E
SCHEMBL24254545 0.78 SELL (0.45) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL24254575 0.78 MAPT (0.53) MAPTMEN1KMT2AKCNQ2KDM4E
SCHEMBL24254498 0.75 ALDH1A1 (0.63) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL24254578 0.74 L3MBTL1 (0.57) MAPTMEN1KMT2AKDM4EGAA
SCHEMBL26077917 0.72 MEN1 (0.55) MAPTMEN1KMT2AKCNQ2MAPK8
SCHEMBL13753606 0.71 MEN1 (0.63) MAPTMEN1KMT2AKCNQ2KDM4E
SCHEMBL6850939 0.71 MEN1 (0.67) MAPTMEN1KMT2AKCNQ2KDM4E
SCHEMBL1853620 0.70 MEN1 (0.62) MAPTMEN1KMT2AKCNQ2KDM4E

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-2022035804-A1 SUBSTITUTED 3-AMINO-4-METHYLBENZENESULFONAMIDES AS SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-17 WO disclosed