SCHEMBL13552596

SCHEMBL13552596

Cc1nccc(-c2cccc(S(=O)(=O)Nc3ccsc3C(=O)C(=O)[C@H](CCCNC(=N)N)NO)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.40
▸ F10 P00742 1/20 0.40
▸ PLG P00747 1/20 0.40
▸ PLAU P00749 1/20 0.40
▸ ST14 Q9Y5Y6 1/20 0.40
▸ NRP1 O14786 7/20 0.40
▸ LARS1 Q9P2J5 4/20 0.38
▸ DNMT3B Q9UBC3 2/20 0.35
▸ PTGES2 Q9H7Z7 2/20 0.35
▸ NPR1 P16066 1/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ MAOA P21397 1/20 0.33

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
SCHEMBL10067570 0.87 NRP1 (0.55) F2F10PLGPLAUST14
SCHEMBL13552534 0.85 NRP1 (0.53) F2NRP1NPR1
SCHEMBL13552586 0.84 NRP1 (0.43) NRP1NPR1
SCHEMBL13552638 0.80 NRP1 (0.44) F2F10NRP1NPR1
SCHEMBL13552604 0.80 NRP1 (0.40) NRP1NPR1
SCHEMBL13552593 0.80 HDAC3 (0.42) F2F10NRP1
SCHEMBL13552573 0.79 NRP1 (0.41) NRP1PTGES2NPR1
SCHEMBL13552592 0.79 NRP1 (0.48) NRP1NPR1
SCHEMBL13552613 0.79 NRP1 (0.35) NRP1NPR1
SCHEMBL10081980 0.78 NRP1 (0.54) NRP1LARS1NPR1

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-20120269864-A1 Arginine Derivatives with NP-I Antagonistic Activity GB06/019611.7 THERAPIES LIMITED (GB) 2012-10-25 — — 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-20120269864-A1 Arginine Derivatives with NP-I Antagonistic Activity NPFFR1, NPR1, ARG1 F2 2358/4885F10 3292/4885PLG 3101/4885

“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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