SCHEMBL6713832

SCHEMBL6713832

CN(c1ccc(Cl)cc1)S(=O)(=O)c1csc(C(=O)Nc2ccc(Br)cc2C#N)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
SIRT2 Q8IXJ6 12/20 0.47
HTT P42858 4/20 0.42
APAF1 O14727 1/20 0.42
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL6833863 0.85 METAP2 (0.48) KDM4EALDH1A1SIRT2HTTMAPK1
SCHEMBL6709145 0.85 SIRT2 (0.56) MAPTKDM4EALDH1A1HPGDSIRT2
SCHEMBL6710371 0.84 MAPT (0.46) MAPTKDM4EALDH1A1HPGDSIRT2
SCHEMBL6708825 0.79 SIRT2 (0.38) MAPTKDM4ESIRT2HTTMAPK1
SCHEMBL15838803 0.74 SIRT2 (0.73) MAPTKDM4EALDH1A1HPGDSIRT2
SCHEMBL6710402 0.73 ALAD (0.49) KDM4ESIRT2HTTMAPK1MEN1
SCHEMBL15953505 0.72 SIRT2 (0.74) MAPTKDM4EALDH1A1HPGDSIRT2
SCHEMBL6351360 0.69 METAP2 (0.55) MAPTKDM4ESIRT2HTTMAPK1
SCHEMBL6833131 0.69 METAP2 (0.47) MAPTKDM4ESIRT2MEN1KMT2A
SCHEMBL6819031 0.69 METAP2 (0.46) MAPTKDM4ESIRT2HTTMAPK1

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 US disclosed
WO-2004018461-A2 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 MAPT 4754/4885KDM4E 1582/4885ALDH1A1 123/4885

“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.