SCHEMBL22009368

SCHEMBL22009368

CC(C)(C)C(=O)C(N)Cc1ccc(C(=N)N)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 7/20 0.45
PRSS2 P07478 4/20 0.45
PRSS3 P35030 4/20 0.45
F2 P00734 4/20 0.45
PLG P00747 1/20 0.45
C1S P09871 1/20 0.45
F10 P00742 2/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
TPH1 P17752 1/20 0.44
NQO2 P16083 3/20 0.43
ST14 Q9Y5Y6 4/20 0.42
TMPRSS6 Q8IU80 2/20 0.41
TMPRSS15 P98073 3/20 0.40
SLC7A5 Q01650 1/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40

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
SCHEMBL22009512 0.87 NQO2 (0.43) PRSS1PRSS2PRSS3F2PLG
SCHEMBL22010463 0.84 TPH1 (0.44) TPH1SLC7A5
SCHEMBL20714851 0.83 PRSS1 (0.50) PRSS1PRSS2PRSS3F2PLG
SCHEMBL22009360 0.82 NQO2 (0.40) PRSS1PRSS2PRSS3F2PLG
SCHEMBL22010051 0.82 L3MBTL1 (0.40) PRSS1F2PLGTPH1SLC7A5
SCHEMBL1397441 0.80 TPH1 (0.66) PRSS1PRSS2PRSS3F2PLG
SCHEMBL288202 0.80 TPH1 (0.66) PRSS1PRSS2PRSS3F2PLG
SCHEMBL1064252 0.80 TPH1 (0.66) PRSS1PRSS2PRSS3F2PLG
SCHEMBL16501755 0.80 SLC7A5 (0.62) SLC7A5
SCHEMBL12194007 0.80 SLC7A5 (0.44) TPH1SLC7A5

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200157144-A1 ANTIMICROBIAL PEPTIDOMIMETICS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-05-21 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-20200157144-A1 ANTIMICROBIAL PEPTIDOMIMETICS NGLY1, GLMN, GMPS PRSS1 2829/4885PRSS2 3045/4885PRSS3 2745/4885

“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.