SCHEMBL22409429

SCHEMBL22409429

CCOP(=O)(CCCN1CCN(CC[C@H](CSc2ccccc2)NC(=O)OC(C)(C)C)CC1)OCC

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
DRD2 P14416 5/20 0.37
BCL2L1 Q07817 2/20 0.37
HRH2 P25021 6/20 0.36
HRH1 P35367 6/20 0.36
SYK P43405 1/20 0.36
ATM Q13315 1/20 0.35
CTSK P43235 1/20 0.35

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
SCHEMBL22409431 1.00 SIGMAR1 (0.39) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL19014884 0.95 BCL2L1 (0.38) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL19014629 0.91 BCL2L1 (0.38) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22409407 0.91 DRD2 (0.40) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22409406 0.91 DRD2 (0.40) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22409464 0.90 SIGMAR1 (0.39) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22409434 0.90 HRH2 (0.40) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22409465 0.90 SIGMAR1 (0.39) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22409435 0.90 HRH2 (0.40) SIGMAR1KDM4EALDH1A1DRD2BCL2L1
SCHEMBL22203001 0.88 ALDH1A1 (0.39) KDM4EALDH1A1HRH2HRH1

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-11111259-B2 Acylsulfonamide derivatives for treating senescence-associated diseases and disorders UNITY BIOTECHNOLOGY, INC. (US) 2021-09-07 US disclosed
US-20200291050-A1 ACYLSULFONAMIDE DERIVATIVES FOR TREATING SENESCENCE-ASSOCIATED DISEASES AND DISORDERS UNITY BIOTECHNOLOGY, INC. 2020-09-17 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 (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-11111259-B2 Acylsulfonamide derivatives for treating senescence-associated diseases and disorders ACAT1, ARSA, GLA SIGMAR1 4672/4885KDM4E 1998/4885ALDH1A1 611/4885
US-20200291050-A1 ACYLSULFONAMIDE DERIVATIVES FOR TREATING SENESCENCE-ASSOCIATED DISEASES AND DISORDERS ACAT1, ARSA, GLA SIGMAR1 4672/4885KDM4E 1998/4885ALDH1A1 611/4885

“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.