SCHEMBL22149144

SCHEMBL22149144

CCOc1cc([C@H](O)CS(C)(=O)=O)ccc1OC

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.59
PDE4A P27815 10/20 0.59
PDE4C Q08493 10/20 0.59
PDE4D Q08499 10/20 0.59
HTR2B P41595 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL18315415 1.00 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL29689563 1.00 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL15194522 1.00 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL23365792 0.86 PDE4B (0.61) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL18679863 0.86 PDE4B (0.61) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL28025841 0.85 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL22790744 0.84 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DHTR2B
SCHEMBL17287625 0.84 GAA (0.51) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL18652088 0.84 ALDH1A1 (0.50) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL753579 0.83 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11149003-B2 Resolution of racemic beta-aminosulfone compounds QUIMICA SINTETICA, S.A. (ES) 2021-10-19 US disclosed
US-20200199072-A1 RESOLUTION OF RACEMIC BETA-AMINOSULFONE COMPOUNDS QUIMICA SINTETICA, S.A. (ES) 2020-06-25 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 (2 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-20200199072-A1 RESOLUTION OF RACEMIC BETA-AMINOSULFONE COMPOUNDS TPMT, DHPS, SRMS PDE4B 336/4885PDE4A 398/4885PDE4C 1190/4885
US-11149003-B2 Resolution of racemic beta-aminosulfone compounds TPMT, DHPS, SRMS PDE4B 336/4885PDE4A 398/4885PDE4C 1190/4885

“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.