SCHEMBL14524261

SCHEMBL14524261

CNC(=O)C1CCCN1C(=O)C(Cc1ccc(O)cc1)NC(=O)C(N)CSSC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 1/20 0.47
▸ RAMP3 O60896 1/20 0.44
▸ CALCR P30988 1/20 0.44
▸ LCK P06239 1/20 0.44
▸ OPRM1 P35372 3/20 0.44
▸ OPRD1 P41143 3/20 0.44
▸ NPFFR1 Q9GZQ6 2/20 0.44
▸ NPFFR2 Q9Y5X5 2/20 0.44
▸ NPY5R Q15761 6/20 0.43
▸ NPY1R P25929 5/20 0.43
▸ NPY4R P50391 5/20 0.43
▸ NPY2R P49146 3/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ NMUR2 Q9GZQ4 1/20 0.42
▸ NMUR1 Q9HB89 1/20 0.42
▸ KDM1A O60341 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ KDM5A P29375 1/20 0.42
▸ KDM1B Q8NB78 1/20 0.42
▸ C5AR1 P21730 1/20 0.42

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
SCHEMBL13311924 0.96 PIN1 (0.49) PIN1RAMP3CALCRLCKOPRM1
SCHEMBL29483768 0.79 TDP1 (0.56) NPY5RNPY1RNPY4RNPY2R
SCHEMBL14524247 0.79 EPHA2 (0.48) PIN1RAMP3CALCROPRM1OPRD1
SCHEMBL13311908 0.79 TDP1 (0.61) —
SCHEMBL10358936 0.78 LCK (0.50) PIN1LCKOPRM1DRD3NMUR2
SCHEMBL14524231 0.77 TDP1 (0.54) —
SCHEMBL13311852 0.77 TDP1 (0.55) NPY5RNPY1RNPY4RNPY2R
SCHEMBL13311883 0.77 TDP1 (0.57) —
SCHEMBL13311807 0.76 TDP1 (0.56) NPY5RNPY1RNPY4RNPY2R
SCHEMBL13432796 0.76 TDP1 (0.54) —

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-20070078094-A1 Guanidinium delivery carriers NITTO DENKO CORPORATION (JP) 2007-04-05 — — US disclosed
US-20070078094-A1 Guanidinium delivery carriers NITTO DENKO CORPORATION (JP) 2007-04-05 — — 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-20070078094-A1 Guanidinium delivery carriers SLC2A9, SLC29A2, SLC2A4 PIN1 3874/4885RAMP3 877/4885CALCR 2301/4885

“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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