SCHEMBL20182251

SCHEMBL20182251

O=C(CCCCC1SCC2NC(=O)NC21)NC(Cc1c[nH]c2ccc(O)cc12)C(=O)NCCc1c[nH]c2ccc(O)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 10/20 0.47
▸ SPR P35270 3/20 0.47
▸ CA12 O43570 2/20 0.47
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ SLC6A4 P31645 1/20 0.46
▸ CAPN1 P07384 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ FAAH O00519 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ IDO1 P14902 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ BLM P54132 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
SCHEMBL20168527 1.00 TRPV1 (0.47) TRPV1SPRCA12CA1CA2
SCHEMBL20168529 1.00 TRPV1 (0.47) TRPV1SPRCA12CA1CA2
SCHEMBL20168642 0.91 SLC6A4 (0.53) CA12CA1CA2CA9SLC6A4
SCHEMBL20168641 0.91 SLC6A4 (0.53) CA12CA1CA2CA9SLC6A4
SCHEMBL30109374 0.83 SPR (0.47) TRPV1SPRCA12CA1CA2
SCHEMBL5806608 0.80 SLC6A4 (0.54) CA12CA1CA2CA9SLC6A4
SCHEMBL9787693 0.79 MMP1 (0.55) SLC6A4CAPN1TDP1
SCHEMBL26073693 0.79 SLC6A4 (0.53) CA12CA1CA2CA9SLC6A4
SCHEMBL20182419 0.78 TRPV1 (0.70) TRPV1SPRFAAHPTGS2KDM4E
SCHEMBL21470293 0.78 TRPV1 (0.70) TRPV1SPRFAAHPTGS2KDM4E

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-11352326-B2 Myeloperoxidase imaging agents THE GENERAL HOSPITAL CORPORATION (US) 2022-06-07 — — US disclosed
US-20190315689-A1 Myeloperoxidase Imaging Agents THE GENERAL HOSPITAL CORPORATION 2019-10-17 — — US disclosed
WO-2018094005-A1 MYELOPEROXIDASE IMAGING AGENTS THE GENERAL HOSPITAL CORPORATION (US) 2018-05-24 — — WO 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-20190315689-A1 Myeloperoxidase Imaging Agents MPO, CAT, EPX TRPV1 3731/4885SPR 242/4885CA12 936/4885
US-11352326-B2 Myeloperoxidase imaging agents MPO, CAT, EPX TRPV1 3731/4885SPR 242/4885CA12 936/4885

“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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