SCHEMBL3701266

SCHEMBL3701266

N=C(N)NCCC[C@H](NC(=O)c1ccc(-c2ccccc2)cc1NS(=O)(=O)c1ccc(N)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NRP1 O14786 2/20 0.47
ACLY P53396 9/20 0.47
MMP2 P08253 7/20 0.42
MMP9 P14780 7/20 0.42
MCL1 Q07820 2/20 0.42
MMP1 P03956 1/20 0.40
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
MMP13 P45452 1/20 0.40
MMP8 P22894 2/20 0.40
MMP12 P39900 2/20 0.40
MMP14 P50281 2/20 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
SCHEMBL4569798 0.90 NRP1 (0.51) NRP1
SCHEMBL4569796 0.82 NRP1 (0.55) NRP1
SCHEMBL4569795 0.80 NRP1 (0.73) NRP1
SCHEMBL3696198 0.80 NRP1 (0.45) NRP1
SCHEMBL4572258 0.77 NRP1 (0.50) NRP1MMP2MMP9
SCHEMBL4569804 0.76 KMT2A (0.47) NRP1ACLYMMP2MMP9
SCHEMBL3711157 0.74 NRP1 (0.74) NRP1
SCHEMBL25158952 0.74 FOLH1 (0.48)
SCHEMBL5892488 0.74 FOLH1 (0.48)
SCHEMBL4569898 0.72 NRP1 (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20120122862-A1 ARGININE DERIVATIVES WITH NP-I ANTAGONISTIC ACTIVITY NPFFR1, NPR1, ARG1 NRP1 145/4885ACLY 3169/4885MMP2 2388/4885

“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.