SCHEMBL7919322

SCHEMBL7919322

Nc1ccn([C@@H]2O[C@H](COC(=O)NCCCCCCC(=O)NO)[C@@H](O)[C@@H]2O)c(=O)n1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
THRB P10828 1/20 0.53
MTOR P42345 1/20 0.53
MDM2 Q00987 1/20 0.53
NCOA1 Q15788 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
PRKACA P17612 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.49
ST6GAL1 P15907 3/20 0.48
TSHR P16473 1/20 0.46
GLA P06280 1/20 0.46
P2RY2 P41231 1/20 0.46

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
SCHEMBL7905695 0.89 LMNA (0.57) LMNATHRBMTORMDM2NCOA1
SCHEMBL7916016 0.89 LMNA (0.57) LMNATHRBMTORMDM2NCOA1
SCHEMBL12104058 0.89 LMNA (0.57) LMNATHRBMTORMDM2NCOA1
SCHEMBL12102510 0.89 LMNA (0.57) LMNATHRBMTORMDM2NCOA1
SCHEMBL7919327 0.89 PRKACA (0.48) PRKACAP2RY2
SCHEMBL7916018 0.87 P2RY2 (0.51) PRKACAP2RY2
SCHEMBL23066250 0.80 P2RY2 (0.57) PRKACAL3MBTL1P2RY2
SCHEMBL20668749 0.80 P2RY2 (0.57) PRKACAL3MBTL1P2RY2
SCHEMBL22387135 0.80 P2RY2 (0.57) PRKACAL3MBTL1P2RY2
SCHEMBL26320825 0.80 P2RY2 (0.57) PRKACAL3MBTL1P2RY2

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-RE46144-E1 Hydroxamic acid derivatives PURDUE PHARMACEUTICAL PRODUCTS L.P. (US) 2016-09-13 US disclosed
US-9096627-B2 Hydroxamic acid derivatives PURDUE PHARMACEUTICAL PRODUCTS L.P. (US) 2015-08-04 US disclosed
US-20140066419-A1 HYDROXAMIC ACID DERIVATIVES PURDUE PHARMACEUTICAL PRODUCTS L.P. (US) 2014-03-06 US disclosed
US-20110269706-A1 Hydroxamic Acid Derivatives NORTHLAKE BIOSCIENCES LLC (US) 2011-11-03 US disclosed
WO-2010085377-A2 HYDROXAMIC ACID DERIVATIVES CRYSTAL BIOPHARMACEUTICAL LLC (US) 2010-07-29 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 (2 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-20140066419-A1 HYDROXAMIC ACID DERIVATIVES HDAC5, HDAC7, HDAC4 LMNA 2696/4885THRB 2862/4885MTOR 2306/4885
US-20110269706-A1 Hydroxamic Acid Derivatives CD74, HLA-DRB1, HDAC5 LMNA 3497/4885THRB 3418/4885MTOR 3158/4885

“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.