SCHEMBL7223447

SCHEMBL7223447

COC(=O)CCc1ccc2c(CC(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)C(=O)OC(C)(C)C)occ2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
IDO1 P14902 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
F10 P00742 2/20 0.33
SLC1A2 P43004 1/20 0.33
PLG P00747 1/20 0.33
NR3C1 P04150 1/20 0.33
NR3C2 P08235 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EEF2K O00418 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HIF1A Q16665 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KDM4A O75164 1/20 0.32
GHSR Q92847 1/20 0.32

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
SCHEMBL6978547 0.91 ALDH1A1 (0.52) ALDH1A1MAPTIDO1MEN1KMT2A
SCHEMBL7230948 0.85 CA12 (0.37) ALDH1A1MAPTIDO1NPSR1
SCHEMBL7223443 0.84 ALDH1A1 (0.41) ALDH1A1MAPTIDO1MEN1KMT2A
SCHEMBL7224793 0.80 TDP1 (0.36) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL7599894 0.80 PTPN1 (0.33) ALDH1A1MAPTIDO1KDM4E
SCHEMBL6973856 0.78 CA12 (0.37) ALDH1A1MAPTNPSR1
SCHEMBL7231340 0.78 CASP1 (0.47) ALDH1A1MEN1KMT2AKDM4E
SCHEMBL7690008 0.77 ALDH1A1 (0.52) ALDH1A1MAPTIDO1MEN1KMT2A
SCHEMBL6978544 0.74 ALDH1A1 (0.52) ALDH1A1MAPTMEN1KMT2ASLC1A2
SCHEMBL6961707 0.72 ITGB3 (0.60) ALDH1A1MAPT

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-6586442-B2 Benzofurane derivatives, their preparation process, their use as medicaments and the pharmaceutical compositions containing them CARNIATO DENIS (FR) 2003-07-01 US disclosed
US-20020187976-A1 New benzofurane derivatives, their preparation process, their use as medicaments and the pharmaceutical compositions containing them AVENTIS PHARMA S.A. 2002-12-12 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-20020187976-A1 New benzofurane derivatives, their preparation process, their use as medicaments and the pharmaceutical compositions containing them CYP2F1, CYP2C19, CYP2B6 ALDH1A1 303/4885MAPT 1796/4885IDO1 4106/4885

“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.