SCHEMBL30367273

SCHEMBL30367273

Cc1ccc(S(=O)(=O)OC[C@@H]2CCCOC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC12A2 P55011 1/20 0.40
SLC12A5 Q9H2X9 1/20 0.40
ALDH1A1 P00352 5/20 0.39
CYP2D6 P10635 4/20 0.39
CYP3A4 P08684 3/20 0.39
TSHR P16473 3/20 0.39
MAPT P10636 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK1 P28482 1/20 0.39
FFAR2 O15552 1/20 0.38
CYP1A2 P05177 1/20 0.37
POLB P06746 2/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36

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
SCHEMBL1192284 1.00 SLC12A2 (0.40) SLC12A2SLC12A5ALDH1A1CYP2D6CYP3A4
SCHEMBL10171748 0.92 ALDH1A1 (0.42) SLC12A2SLC12A5ALDH1A1CYP2D6CYP3A4
SCHEMBL4347000 0.92 ALDH1A1 (0.42) SLC12A2SLC12A5ALDH1A1CYP2D6CYP3A4
SCHEMBL2222219 0.92 ALDH1A1 (0.42) SLC12A2SLC12A5ALDH1A1CYP2D6CYP3A4
SCHEMBL12097863 0.85 ALDH1A1 (0.40) ALDH1A1CYP2D6CYP3A4TSHRMAPT
SCHEMBL31662397 0.85 ALDH1A1 (0.40) ALDH1A1CYP2D6CYP3A4TSHRMAPT
SCHEMBL283868 0.84 ACHE (0.46) ALDH1A1CYP2D6CYP3A4TSHRMAPT
SCHEMBL79261 0.84 ALDH1A1 (0.46) ALDH1A1CYP2D6CYP3A4TSHRMAPT
SCHEMBL8067702 0.83 PRMT5 (0.46) ALDH1A1MAPTFFAR2ACHEMEN1
SCHEMBL282892 0.82 CYP2D6 (0.40) ALDH1A1CYP2D6CYP3A4TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183219-A1 CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2023-06-15 US disclosed
US-20230150986-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNITED STATES GOVERNMENT 2023-05-18 US disclosed
US-20230122344-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNITED STATES GOVERNMENT 2023-04-20 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 (3 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-20230183219-A1 CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM3, CHRM2, CHRM4 SLC12A2 3490/4885SLC12A5 3461/4885ALDH1A1 1756/4885
US-20230122344-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM2, CHRM3, CHRM4 SLC12A2 4238/4885SLC12A5 4008/4885ALDH1A1 1973/4885
US-20230150986-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM3, CHRM2, CHRM4 SLC12A2 3894/4885SLC12A5 3708/4885ALDH1A1 2208/4885

“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.