SCHEMBL31535705

SCHEMBL31535705

COc1cc2c(c(S(=O)(=O)Cl)c1)OCC2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.39
TRPV4 Q9HBA0 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DRD2 P14416 1/20 0.33
TSHR P16473 2/20 0.33
PARP1 P09874 1/20 0.33
HTR6 P50406 2/20 0.32
MAPT P10636 2/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
EGFR P00533 1/20 0.30
NFE2L2 Q16236 1/20 0.30

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
SCHEMBL29682808 0.79 HTR3A (0.37) CYP2A6TRPV4PARP1MAPT
SCHEMBL21046810 0.79 HTR3A (0.37) CYP2A6TRPV4PARP1MAPT
SCHEMBL31172543 0.78 PTGS1 (0.34) CYP2A6KDM4EPARP1HTR6MAPT
SCHEMBL29469917 0.78 NPSR1 (0.36) PARP1MAPT
SCHEMBL743679 0.78 NPSR1 (0.36) PARP1MAPT
SCHEMBL31553890 0.78 PARP1 (0.51) PARP1
SCHEMBL31172611 0.74 MAPT (0.36) TRPV4TSHRPARP1MAPTL3MBTL1
SCHEMBL5308756 0.71 PTGS2 (0.47) SMN1; SMN2TSHRL3MBTL1
SCHEMBL4648923 0.71 PARP1 (0.42) CYP2A6KDM4EGAASMN1; SMN2DRD2
SCHEMBL25046178 0.71 TRPV4 (0.44) TRPV4KDM4EGAATSHRMAPT

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
US-20250122182-A1 MYST Inhibitors Isosterix, Inc. 2025-04-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250122182-A1 MYST Inhibitors MNAT1, SUGT1, ACAT2 CYP2A6 4365/4885TRPV4 4752/4885KDM4E 844/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.