SCHEMBL2265468

SCHEMBL2265468

N/C(CCC(=O)NCCC(O)c1coc(-c2ccc(F)cc2)n1)=N\O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 2/20 0.39
HDAC8 Q9BY41 3/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HPGD P15428 1/20 0.37
SCN9A Q15858 1/20 0.33
PDE4B Q07343 3/20 0.32
SHMT1 P34896 1/20 0.32
PDE4D Q08499 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL2265476 1.00 GAA (0.39) GAATSHRKMT2ALMNAHDAC8
SCHEMBL2266329 0.82 GAA (0.40) GAATSHRKMT2ALMNAHDAC8
SCHEMBL2224728 0.79 HDAC1 (0.38) GAATSHRKMT2ALMNAHDAC8
SCHEMBL2224718 0.79 HDAC1 (0.38) GAATSHRKMT2ALMNAHDAC8
SCHEMBL2357273 0.76 HDAC4 (0.36) GAATSHRKMT2ALMNAHDAC8
SCHEMBL14243980 0.76 TSHR (0.47) GAATSHRKMT2ALMNAHDAC8
SCHEMBL12517104 0.76 TSHR (0.47) GAATSHRKMT2ALMNAHDAC8
SCHEMBL2223339 0.76 HDAC8 (0.43) GAATSHRKMT2ALMNAHDAC8
SCHEMBL12518546 0.72 HDAC8 (0.40) GAATSHRKMT2ALMNAHDAC8
SCHEMBL2267431 0.72 HDAC8 (0.40) GAATSHRKMT2ALMNAHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120322827-A1 COMPOUNDS AND METHODS TEMPERO PHARAMCEUTICALS. INC. 2012-12-20 US disclosed
US-20120322827-A1 COMPOUNDS AND METHODS TEMPERO PHARAMCEUTICALS. INC. 2012-12-20 US disclosed
EP-2523560-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals, Inc. (US) 2012-11-21 EP disclosed
WO-2011088187-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 WO disclosed
WO-2011088187-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 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-20120322827-A1 COMPOUNDS AND METHODS XDH, LPXN, CCNY GAA 1423/4885TSHR 1177/4885KMT2A 2487/4885

“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.