SCHEMBL24254578

SCHEMBL24254578

Cc1ccc(SN(C)C)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
LMNA P02545 5/20 0.55
KMT2A Q03164 7/20 0.52
ALDH1A1 P00352 5/20 0.50
MEN1 O00255 5/20 0.50
MAPT P10636 4/20 0.50
KDM4E B2RXH2 2/20 0.50
POLB P06746 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
GAA P10253 1/20 0.47
HTT P42858 1/20 0.46

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
SCHEMBL24254545 0.85 SELL (0.45) L3MBTL1LMNAKMT2AMEN1MAPT
SCHEMBL24254523 0.83 HPGD (0.59) L3MBTL1LMNAKMT2AALDH1A1MEN1
SCHEMBL26188046 0.80 ALDH1A1 (0.58) L3MBTL1LMNAKMT2AALDH1A1MEN1
SCHEMBL24254575 0.80 MAPT (0.53) L3MBTL1LMNAKMT2AALDH1A1MEN1
SCHEMBL24254539 0.74 MAPT (0.53) LMNAKMT2AALDH1A1MEN1MAPT
SCHEMBL24254498 0.72 ALDH1A1 (0.63) LMNAKMT2AALDH1A1MEN1MAPT
SCHEMBL6785823 0.71 HTT (0.57) L3MBTL1LMNAKMT2AALDH1A1MEN1
SCHEMBL2071340 0.71 L3MBTL1 (0.81) L3MBTL1LMNAKMT2AALDH1A1MEN1
SCHEMBL6405857 0.70 ALDH1A1 (0.73) L3MBTL1LMNAKMT2AALDH1A1MEN1
SCHEMBL16098448 0.69 ALDH1A1 (0.67) L3MBTL1LMNAKMT2AALDH1A1MEN1

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