SCHEMBL13537183

SCHEMBL13537183

CB(O)NC(C)c1cccc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC5 Q9UQL6 1/20 0.44
▸ MTOR P42345 1/20 0.42
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ ROCK2 O75116 3/20 0.38
▸ ROCK1 Q13464 3/20 0.38
▸ BAZ1A Q9NRL2 1/20 0.38
▸ GPR139 Q6DWJ6 1/20 0.38
▸ CASR P41180 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ EGFR P00533 1/20 0.37

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
SCHEMBL12150259 0.79 MAPKAPK2 (0.41) —
SCHEMBL13537185 0.79 RPS6KB1 (0.42) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL13537188 0.79 ROCK1 (0.44) HDAC4HDAC7HDAC5ROCK2ROCK1
SCHEMBL13537191 0.78 HDAC4 (0.40) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL13537184 0.78 HDAC4 (0.46) HDAC4HDAC7HDAC5MTORCES2
SCHEMBL15247594 0.76 HDAC4 (0.50) HDAC4HDAC7HDAC5MTORCES2
SCHEMBL10087244 0.76 HDAC4 (0.46) HDAC4HDAC7HDAC5MTORCES2
SCHEMBL17614064 0.76 HDAC4 (0.46) HDAC4HDAC7HDAC5MTORCES2
SCHEMBL16168343 0.76 HDAC4 (0.46) HDAC4HDAC7HDAC5MTORCES2
SCHEMBL22365056 0.74 HDAC4 (0.44) HDAC4HDAC7HDAC5MTORCES2

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-7649015-B2 Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds GILEAD SCIENCES, INC. (US) 2010-01-19 — — US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 — — 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-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 HDAC4 1277/4885HDAC7 1367/4885HDAC5 1158/4885

“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.

Send feedback