SCHEMBL17351950

SCHEMBL17351950

COc1nc(NC(=O)NS(=O)(=O)c2ccccc2C(F)(F)F)nc(C23CC4CC(CC(C4)C2)C3)n1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
HSD11B1 P28845 4/20 0.38
ALKBH2 Q6NS38 1/20 0.37
ALKBH3 Q96Q83 1/20 0.37
FTO Q9C0B1 1/20 0.37
SLC22A12 Q96S37 3/20 0.37
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
USP2 O75604 1/20 0.34
USP8 P40818 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
SCHEMBL29508588 0.81 MAPT (0.45) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL53993 0.81 MAPT (0.45) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL30116869 0.81 MAPT (0.45) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL6829101 0.80 MAPT (0.44) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL2973031 0.80 MAPT (0.44) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL7561744 0.79 MAPT (0.43) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL7180471 0.78 ALDH1A1 (0.50) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL7567488 0.78 MAPT (0.42) MAPTALDH1A1KDM4ENPC1ALKBH2
Sulfuric Acid SCHEMBL21381522 0.77 MAPT (0.42) MAPTALDH1A1KDM4ENPC1ALKBH2
SCHEMBL2108588 0.74 GAA (0.41) MAPTALDH1A1KDM4ENPC1ALKBH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150366191-A1 ANTIMICROBIAL METHOD BY BLOCKING MANNITOL METABOLISM AND ANTIMICROBIAL COMPOSITION CONTAINING MANNITOL METABOLIC INHIBITOR Research & Business Foundation Sungkyunkwan University (KR) 2015-12-24 US claimed
US-20150366191-A1 ANTIMICROBIAL METHOD BY BLOCKING MANNITOL METABOLISM AND ANTIMICROBIAL COMPOSITION CONTAINING MANNITOL METABOLIC INHIBITOR Research & Business Foundation Sungkyunkwan University (KR) 2015-12-24 US disclosed
US-20150366191-A1 ANTIMICROBIAL METHOD BY BLOCKING MANNITOL METABOLISM AND ANTIMICROBIAL COMPOSITION CONTAINING MANNITOL METABOLIC INHIBITOR Research & Business Foundation Sungkyunkwan University (KR) 2015-12-24 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-20150366191-A1 ANTIMICROBIAL METHOD BY BLOCKING MANNITOL METABOLISM AND ANTIMICROBIAL COMPOSITION CONTAINING MANNITOL METABOLIC INHIBITOR PHGDH, MDH2, MDH1 MAPT 1056/4885ALDH1A1 273/4885KDM4E 3301/4885

“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.