SCHEMBL6352256

SCHEMBL6352256

N#Cc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2)c(C(=O)O)c1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.70
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
MAPT P10636 2/20 0.49
HSD11B1 P28845 1/20 0.48
SERPINE1 P05121 2/20 0.46
ERO1A Q96HE7 1/20 0.44
TNF P01375 3/20 0.44
NOD2 Q9HC29 3/20 0.44
NOD1 Q9Y239 3/20 0.44
KCNK2 O95069 1/20 0.43
KCNK10 P57789 1/20 0.43
GPR6 P46095 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
AKR1C4 P17516 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 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
SCHEMBL6355451 0.92 ALB (0.67) ALBKMT2AMEN1AKR1C4AKR1C3
SCHEMBL6357952 0.84 ALB (0.83) ALBKMT2AMEN1ALDH1A1
SCHEMBL6349310 0.84 ALB (0.83) ALBKMT2AMEN1ALDH1A1
SCHEMBL6821690 0.83 ALB (0.49) ALBKMT2AMEN1MAPTHSD11B1
SCHEMBL6349827 0.83 ALB (1.00) ALBKMT2AMEN1ALDH1A1
SCHEMBL6352010 0.83 ALB (0.81) ALBKMT2AMEN1ALDH1A1TDP1
SCHEMBL6358241 0.81 ALB (0.64) ALBKMT2A
SCHEMBL6352516 0.81 ALB (0.62) ALBKMT2AMAPTALDH1A1
SCHEMBL6359827 0.80 ALB (0.77) ALBKMT2AMEN1ALDH1A1
SCHEMBL6357110 0.80 ALB (0.65) ALBKMT2AMEN1MAPTGPR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 US claimed

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 ALB 1682/4885KMT2A 3645/4885MEN1 3274/4885

“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.