SCHEMBL16181241

SCHEMBL16181241

CC(C)C(NC(=O)[C@H](CCCNC(=N)N)NC(=O)Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCCCCN

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 5/20 0.55
▸ CHRNA1 P02708 4/20 0.53
▸ CHRNG P07510 4/20 0.53
▸ CHRNB1 P11230 4/20 0.53
▸ CHRND Q07001 4/20 0.53
▸ GRIN1 Q05586 3/20 0.52
▸ GRIN2A Q12879 3/20 0.52
▸ F2 P00734 2/20 0.49
▸ CTSL P07711 1/20 0.49
▸ GRIA1 P42261 1/20 0.49
▸ TLR2 O60603 1/20 0.48
▸ TFPI P10646 1/20 0.47
▸ CPB1 P15086 1/20 0.47
▸ CPB2 Q96IY4 1/20 0.47

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
SCHEMBL16181257 0.95 FURIN (0.53) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL16181263 0.90 FURIN (0.49) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL16181249 0.90 FURIN (0.49) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL30423373 0.87 NPY4R (0.47) FURINCHRNA1CHRNGCHRNB1CHRND
SCHEMBL16181609 0.85 FURIN (0.52) FURINF2
SCHEMBL16181237 0.85 FURIN (0.52) FURINF2
SCHEMBL7920067 0.85 FURIN (0.52) FURINF2
SCHEMBL16181274 0.84 NPY1R (0.51) FURINCTSLTFPI
SCHEMBL10027647 0.83 NPY4R (0.53) TFPI
SCHEMBL16502367 0.82 BDKRB1 (0.45) FURINGRIN1GRIN2ACTSL

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-8865865-B2 N-terminally modified tetrapeptide derivatives having a C-terminal arginine mimetic PHILIPPS-UNIVERSITAT MARBURG (DE) 2014-10-21 — — US disclosed
US-20110312873-A1 N-TERMINALLY MODIFIED TETRAPEPTIDE DERIVATIVES HAVING A C-TERMINAL ARGININE MIMETIC PHILIPPS-UNIVERSITAT MARBURG (DE) 2011-12-22 — — 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-20110312873-A1 N-TERMINALLY MODIFIED TETRAPEPTIDE DERIVATIVES HAVING A C-TERMINAL ARGININE MIMETIC FURIN, IAPP, APP FURIN 1/4885CHRNA1 4540/4885CHRNG 3443/4885

“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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