SCHEMBL12829327

SCHEMBL12829327

CC(C)(C)c1ccc2oc(NS(C)(=O)=O)nc2c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 16/20 0.65
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.53
KMT2A Q03164 1/20 0.53
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
GFER P55789 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL12829824 0.89 FBP1 (0.52) FBP1MEN1MAPTKMT2AHDAC6
SCHEMBL128635 0.81 FBP1 (0.61) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL9883987 0.77 FBP1 (0.52) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL18233032 0.74 NPC1 (0.60) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL33525267 0.72 IL6 (0.61) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL28479671 0.72 CA1 (0.43) FBP1
SCHEMBL15450959 0.72 FBP1 (0.61) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL4399183 0.72 L3MBTL1 (0.53) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL2706413 0.72 NPC1 (0.49) FBP1MEN1MAPTKMT2ANPC1
SCHEMBL23095285 0.70 NPC1 (0.48) FBP1MEN1MAPTKMT2ANPC1

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-20110077268-A1 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-03-31 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-20110077268-A1 KINASE INHIBITORS AND METHODS OF USE MAP3K20, MAP3K1, PDPK1 FBP1 707/4885MEN1 3187/4885MAPT 2921/4885

“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.