SCHEMBL10067798

SCHEMBL10067798

Cn1cc(-c2ccccc2S(=O)(=O)Nc2ccsc2C(=O)C(=O)[C@@H](N)CCCNC(N)N)cn1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.38
NRP1 O14786 10/20 0.36
SLC10A6 Q3KNW5 1/20 0.35
NPR1 P16066 1/20 0.35
ADRA1A P35348 1/20 0.33
LIPC P11150 1/20 0.32
HDAC8 Q9BY41 1/20 0.32

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
SCHEMBL10068133 0.87 LMNA (0.38) BRD4NRP1
SCHEMBL10067739 0.86 NRP1 (0.37) BRD4NRP1SLC10A6NPR1
SCHEMBL4572265 0.86 NRP1 (0.40) BRD4NRP1NPR1
SCHEMBL4572262 0.86 NRP1 (0.53) NRP1NPR1
SCHEMBL10068134 0.85 NRP1 (0.37) NRP1SLC10A6NPR1
SCHEMBL4572277 0.84 SLC10A6 (0.37) BRD4NRP1SLC10A6NPR1
SCHEMBL4572342 0.83 NRP1 (0.49) NRP1
SCHEMBL4572339 0.80 EDNRA (0.37) BRD4NRP1
SCHEMBL4569889 0.79 BRD4 (0.48) BRD4SLC10A6ADRA1A
SCHEMBL4572341 0.79 NRP1 (0.43) NRP1

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-20120269864-A1 Arginine Derivatives with NP-I Antagonistic Activity GB06/019611.7 THERAPIES LIMITED (GB) 2012-10-25 US disclosed
US-8227606-B2 Arginine derivatives with NP-1 antagonistic activity ARK THERAPEUTICS, LTD. (GB) 2012-07-24 US disclosed
US-20120122862-A1 ARGININE DERIVATIVES WITH NP-I ANTAGONISTIC ACTIVITY GB06/019611.7 THERAPIES LIMITED (GB) 2012-05-17 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-20120269864-A1 Arginine Derivatives with NP-I Antagonistic Activity NPFFR1, NPR1, ARG1 BRD4 2083/4885NRP1 145/4885SLC10A6 1440/4885
US-20120122862-A1 ARGININE DERIVATIVES WITH NP-I ANTAGONISTIC ACTIVITY NPFFR1, NPR1, ARG1 BRD4 2083/4885NRP1 145/4885SLC10A6 1440/4885

“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.