SCHEMBL14726490

SCHEMBL14726490

CC(C)(C)OC(=O)NCc1ccc(-c2cc(F)ccc2N)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.57
HDAC1 Q13547 5/20 0.45
HPN P05981 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.42
FAAH O00519 2/20 0.42
NAMPT P43490 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
GAA P10253 1/20 0.41
SDCBP O00560 1/20 0.41
SDC2 P34741 1/20 0.41
HDAC2 Q92769 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39

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
SCHEMBL30336902 0.83 HDAC1 (0.48) GRM2HDAC1L3MBTL1HPGDNAMPT
SCHEMBL23997244 0.83 HDAC1 (0.48) GRM2HDAC1L3MBTL1HPGDNAMPT
SCHEMBL18664525 0.83 GRM2 (0.57) GRM2HDAC1L3MBTL1HPGDFAAH
SCHEMBL13146715 0.83 GRM2 (0.44) GRM2HDAC1L3MBTL1CA1CA2
SCHEMBL14726491 0.82 GRM2 (0.51) GRM2HDAC1HPNL3MBTL1HPGD
SCHEMBL1444314 0.82 HPGD (0.59) GRM2L3MBTL1HPGDFAAHNAMPT
SCHEMBL14718500 0.81 HTT (0.43) HDAC1HPGDHDAC2HDAC3HDAC6
Hydrochloric Acid SCHEMBL27698235 0.80 HPGD (0.58) GRM2L3MBTL1HPGDFAAHNAMPT
SCHEMBL31738223 0.80 GRM2 (0.49) GRM2HDAC1L3MBTL1NAMPTCA1
SCHEMBL2443309 0.80 GRM2 (0.44) GRM2HDAC1L3MBTL1CA1CA2

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-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PALIWAL SUNIL (US) 2013-02-28 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-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PDK1, PDPK1, PDK3 GRM2 2543/4885HDAC1 203/4885HPN 2610/4885

“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.