SCHEMBL23536635

SCHEMBL23536635

CN(C)S(=O)(=O)c1ccc(S(=O)(=O)n2nc(N3CCOCC3)c3ccccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
RXFP1 Q9HBX9 1/20 0.44
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
LMNA P02545 2/20 0.41
PIK3CA P42336 1/20 0.39
TSHR P16473 2/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HTR6 P50406 1/20 0.38
MAPK1 P28482 1/20 0.38
PKM P14618 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
SCHEMBL23536839 0.90 HSD17B10 (0.39) HSD17B10KMT2AMEN1RXFP1CRHBP
SCHEMBL23536533 0.83 HTR6 (0.40) KMT2AMEN1LMNAKDM4EHTR6
SCHEMBL23536550 0.81 HTR6 (0.34) HSD17B10KMT2AMEN1LMNATSHR
SCHEMBL23536666 0.80 GPR119 (0.34) HSD17B10KMT2AMEN1ALDH1A1HTR6
SCHEMBL23536671 0.80 JAK2 (0.34) HSD17B10KMT2AMEN1RXFP1CRHBP
SCHEMBL23536682 0.80 HTR6 (0.34) KMT2ALMNAGAAHTR6
SCHEMBL23536612 0.78 JAK2 (0.35) LMNAKDM4EALDH1A1HTR6
SCHEMBL23536641 0.78 HTT (0.46) KMT2AMEN1LMNATSHRGAA
SCHEMBL23536596 0.76 SLC6A2 (0.39) KMT2AMEN1LMNATSHRGAA
SCHEMBL23536713 0.76 CYP2C19 (0.41) KMT2AMEN1LMNATSHRHTT

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-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed