SCHEMBL21335219

SCHEMBL21335219

CC(C)C(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@H](N)C1CCCCC1)C(C)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 6/20 0.36
▸ GLS O94925 1/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ MITF O75030 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ DPP4 P27487 9/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ DPP7 Q9UHL4 2/20 0.31
▸ KDM1A O60341 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
SCHEMBL17992384 0.91 CPB2 (0.36) CPB2GLSMEN1MITFKMT2A
SCHEMBL21335222 0.88 CPB2 (0.35) CPB2GLSMEN1MITFKMT2A
SCHEMBL19825813 0.88 CPB2 (0.36) CPB2MEN1MITFKMT2AKDM1A
SCHEMBL19825861 0.88 CPB2 (0.38) CPB2MEN1MITFKMT2AKDM1A
SCHEMBL21335156 0.85 CPB2 (0.40) CPB2KMT2AMETAP2
SCHEMBL21335165 0.83 CPB2 (0.34) CPB2KDM1A
SCHEMBL23658150 0.82 CPB2 (0.35) CPB2MEN1MITFKMT2A
SCHEMBL19825818 0.82 CPB2 (0.35) CPB2MEN1MITFKMT2A
SCHEMBL18637675 0.82 FNTA (0.41) CPB2KMT2A
SCHEMBL21335314 0.82 NMT1 (0.38) CPB2KDM1A

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-20200188476-A1 ANTI-MICROBIAL AGENT-POLYMER CONJUGATES AND METHODS OF USE THEREOF UNIV CALIFORNIA (US) 2020-06-18 — — US disclosed
US-10407467-B2 Polymyxin derivatives and their use in combination therapy together with different antibiotics NEW PHARMA LICENCE HOLDINGS LIMITED (MT) 2019-09-10 — — 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 (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-20200188476-A1 ANTI-MICROBIAL AGENT-POLYMER CONJUGATES AND METHODS OF USE THEREOF DDOST, MGAM, MSN CPB2 1548/4885GLS 939/4885MEN1 3883/4885
US-10407467-B2 Polymyxin derivatives and their use in combination therapy together with different antibiotics MRPS18A, MRPL21, RRP1B CPB2 1537/4885GLS 1251/4885MEN1 991/4885

“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.

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