SCHEMBL15727300

SCHEMBL15727300

COC(=O)[C@@H]1CCCCCOC[C@H](N)C(=O)N[C@@H](C)C(=O)N1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.32
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ ANPEP P15144 1/20 0.31
▸ LNPEP Q9UIQ6 1/20 0.31
▸ PSMB9 P28065 2/20 0.30
▸ PPIA P62937 2/20 0.30
▸ PSMB8 P28062 1/20 0.30

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
SCHEMBL15727225 0.93 CTSD (0.32) CTSDKMT2A
SCHEMBL15727251 0.92 CTSD (0.33) CTSDKMT2A
SCHEMBL23736270 0.88 KMT2A (0.32) KMT2A
SCHEMBL23736283 0.82 KMT2A (0.31) KMT2A
SCHEMBL23736271 0.81 ITGB3 (0.34) KMT2APPIA
SCHEMBL23736280 0.81 KMT2A (0.33) KMT2A
SCHEMBL15727299 0.79 CTSD (0.53) CTSDBACE1
SCHEMBL13640163 0.75 KMT2A (0.40) KMT2AANPEPLNPEP
SCHEMBL23736109 0.74 KMT2A (0.32) KMT2APSMB9
SCHEMBL15727316 0.73 CTSD (0.53) CTSDBACE1

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-9309285-B2 Macrocyclic broad spectrum antibiotics RQX PHARMACEUTICALS, INC. (US) 2016-04-12 — — US disclosed
WO-2014081886-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS, INC. (US) 2014-05-30 — — WO disclosed
US-20140142029-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS, INC. (US) 2014-05-22 — — 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-20140142029-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC CTSD 271/4885KMT2A 3283/4885MEN1 2531/4885

“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