SCHEMBL5604046

SCHEMBL5604046

CCCCCCCCCCCCCCCCS(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.56
CA9 Q16790 3/20 0.56
CA7 P43166 2/20 0.56
CA14 Q9ULX7 2/20 0.56
CA2 P00918 2/20 0.56
POLB P06746 2/20 0.55
ITGB3 P05106 1/20 0.53
ITGA2B P08514 1/20 0.53
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
BIRC2 Q13490 1/20 0.51
ITGB1 P05556 1/20 0.49
ITGA4 P13612 1/20 0.49
ATM Q13315 1/20 0.48
ALDH1A1 P00352 1/20 0.47
THRB P10828 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL4067325 0.88 ITGB3 (0.61) POLBITGB3ITGA2BITGB1ITGA4
SCHEMBL5603960 0.88 ITGB3 (0.61) POLBITGB3ITGA2BITGB1ITGA4
SCHEMBL7622370 0.88 ITGB3 (0.61) POLBITGB3ITGA2BITGB1ITGA4
SCHEMBL8733191 0.88 BIRC2 (0.44) CA12CA9CA7CA14CA2
SCHEMBL22164251 0.86 CA12 (0.55) CA12CA9CA7CA14CA2
SCHEMBL22164250 0.86 CA12 (0.55) CA12CA9CA7CA14CA2
SCHEMBL8728179 0.84 SIRT2 (0.47) CA12CA9CA7CA14CA2
SCHEMBL5966640 0.84 CA12 (0.61) CA12CA9CA7CA14CA2
SCHEMBL5966638 0.84 CA12 (0.61) CA12CA9CA7CA14CA2
SCHEMBL7229783 0.84 ITGB3 (0.54) CA12CA9CA7CA14CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1311281-B1 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS MIGENIX INC (CA) 2007-10-24 EP disclosed
EP-1311281-A4 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS MICROLOGIX BIOTECH INC (CA) 2005-08-24 EP disclosed
US-6750199-B2 SULFONYLATION CORE ANTIBIOTIC MICROLOGIX BIOTECH INC. (CA) 2004-06-15 US disclosed
EP-1311281-A1 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS Micrologix Biotech, Inc. (CA) 2003-05-21 EP disclosed
US-20020028771-A1 Antimicrobial sulfonamide derivatives of lipopeptide antibiotics BIOSOURCE PHARM, INC. 2002-03-07 US disclosed
WO-2002005837-A1 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS INTRABIOTICS PHARMACEUTICALS, INC. (US) 2002-01-24 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-20020028771-A1 Antimicrobial sulfonamide derivatives of lipopeptide antibiotics STS, CUTA, LSS CA12 3809/4885CA9 3299/4885CA7 3758/4885

“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.