SCHEMBL14976012

SCHEMBL14976012

CC(C)(C)OC(=O)N(N)CCCC(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.37
CTSK P43235 4/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
APLNR P35414 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
SCHEMBL2713441 0.85 HDAC6 (0.35) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL3747931 0.84 CA14 (0.40) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL8616170 0.81 NOS2 (0.46) MEN1GAAKMT2A
SCHEMBL6024664 0.79 CA1 (0.38) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL8310669 0.79 CA14 (0.41) CA14HDAC1HDAC2HDAC6
SCHEMBL6525725 0.79 CA14 (0.34) CA14HDAC1HDAC2HDAC6APLNR
SCHEMBL27942277 0.77 HDAC6 (0.37) CA14HDAC1HDAC2HDAC6
SCHEMBL1884648 0.77 CA14 (0.40) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL27662317 0.76 HDAC1 (0.39) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL5287476 0.76 HDAC6 (0.39) CA14HDAC1HDAC2HDAC6MEN1

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-20140323418-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-30 US disclosed
EP-2782580-A1 SELECTIVE KINASE INHIBITORS Portola Pharmaceuticals, Inc. (US) 2014-10-01 EP disclosed
WO-2013078468-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 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-20140323418-A1 SELECTIVE KINASE INHIBITORS SYK, BTK, LCK CA14 4838/4885CTSK 622/4885HDAC1 2760/4885

“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.