SCHEMBL4572265

SCHEMBL4572265

Cn1cc(-c2cccc(S(=O)(=O)Nc3ccsc3C(=O)C(=O)[C@@H](N)CCCNC(N)N)c2)cn1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NRP1 O14786 3/20 0.40
LOXL2 Q9Y4K0 1/20 0.38
TRIM24 O15164 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.37
IRAK4 Q9NWZ3 3/20 0.35
KCNH2 Q12809 1/20 0.35
EGFR P00533 3/20 0.35
LARS1 Q9P2J5 2/20 0.35
MET P08581 2/20 0.35
INSR P06213 1/20 0.35
IRAK1 P51617 3/20 0.34
GPR142 Q7Z601 1/20 0.34
SCN9A Q15858 1/20 0.34
NPR1 P16066 1/20 0.34
FGFR1 P11362 1/20 0.34
KDR P35968 1/20 0.34
BRD4 O60885 1/20 0.34

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 0.91 LMNA (0.38) NRP1LOXL2TRIM24SCN9ABRD4
SCHEMBL4572327 0.87 NRP1 (0.55) NRP1NPR1
SCHEMBL10067798 0.86 BRD4 (0.38) NRP1NPR1BRD4
SCHEMBL4572278 0.86 LARS1 (0.47) NRP1PTGES2LARS1NPR1
SCHEMBL4572328 0.85 PTGES2 (0.50) NRP1PTGES2LARS1NPR1
SCHEMBL4572342 0.82 NRP1 (0.49) NRP1
SCHEMBL13554544 0.81 NRP1 (0.42) NRP1NPR1KDRBRD4
SCHEMBL4572266 0.81 BRD4 (0.43) NRP1BRD4
SCHEMBL4572325 0.81 PTGES2 (0.51) NRP1PTGES2
SCHEMBL4569886 0.79 TRIM24 (0.49) NRP1LOXL2TRIM24PTGES2KCNH2

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 NRP1 145/4885LOXL2 4623/4885TRIM24 3199/4885
US-20120122862-A1 ARGININE DERIVATIVES WITH NP-I ANTAGONISTIC ACTIVITY NPFFR1, NPR1, ARG1 NRP1 145/4885LOXL2 4623/4885TRIM24 3199/4885

“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.