SCHEMBL6349299

SCHEMBL6349299

CN(c1ccc(Cl)cc1)S(=O)(=O)c1cc(Br)cc(C(=O)Nc2ccc(C#N)cc2C(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 16/20 0.61
ALB P02768 1/20 0.45
F10 P00742 1/20 0.44
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL6349003 0.90 SIRT2 (0.49) SIRT2ALBKDM4E
SCHEMBL6347687 0.89 METAP2 (0.50) SIRT2ALBKDM4EMAPT
SCHEMBL6358696 0.88 SIRT2 (0.63) SIRT2ALBF10KDM4EALDH1A1
SCHEMBL6351360 0.80 METAP2 (0.55) SIRT2KDM4EMAPT
SCHEMBL6353746 0.79 SIRT2 (0.61) SIRT2ALBALDH1A1MAPT
SCHEMBL6349554 0.78 AKR1C2 (0.48) SIRT2KDM4E
SCHEMBL7063908 0.78 METAP2 (0.50) SIRT2ALBKDM4E
SCHEMBL6833917 0.78 MAPK1 (0.50) SIRT2KDM4EALDH1A1
SCHEMBL6357252 0.77 SIRT2 (0.65) SIRT2ALBALDH1A1MAPT
SCHEMBL15838774 0.76 SIRT2 (1.00) SIRT2

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-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 US claimed
US-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 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-20050113450-A1 Antibacterial agents CLPP, SPOUT1, SAMHD1 SIRT2 3380/4885ALB 1682/4885F10 2427/4885

“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.