SCHEMBL3756317

SCHEMBL3756317

CS(=O)(=O)N1CCC(CCCl)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
ATM Q13315 1/20 0.46
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
NPSR1 Q6W5P4 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.37
OPRL1 P41146 1/20 0.37
RECQL P46063 1/20 0.36
FABP6 P51161 1/20 0.35
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL1964281 0.83 TP53 (0.44) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL4486230 0.82 ALDH1A1 (0.47) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL13254838 0.80 ALDH1A1 (0.46) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL11980468 0.80 ALDH1A1 (0.46) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL13598984 0.78 ALDH1A1 (0.53) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL9917296 0.78 ALDH1A1 (0.45) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL3749547 0.78 ALDH1A1 (0.42) ALDH1A1ATMNPSR1TSHRFABP6
SCHEMBL4402796 0.78 ALDH1A1 (0.44) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL23387623 0.77 ALDH1A1 (0.47) ALDH1A1ATMTP53L3MBTL1NPSR1
SCHEMBL22123216 0.77 ALDH1A1 (0.44) ALDH1A1ATMTP53L3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders MYRIAD PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders MYRIAD PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders MYRIAD PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
WO-2009065035-A1 THERAPEUTIC COMPOUNDS AND THEIR USE IN TREATING DISEASES AND DISORDERS MYRIAD GENETICS, INC. (US) 2009-05-22 WO 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-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders VHL, CLN6, CFTR ALDH1A1 515/4885ATM 1816/4885TP53 14/4885

“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.