SCHEMBL518160

SCHEMBL518160

O=C(Oc1ccc([N+](=O)[O-])cc1)N1CC(Oc2ccc(I)cn2)C1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.48
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ MGLL Q99685 4/20 0.43
▸ TRPV1 Q8NER1 1/20 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
SCHEMBL13692025 0.91 FAAH (0.47) FAAHCYP1A2CYP2D6MGLL
SCHEMBL518294 0.87 FAAH (0.46) FAAHCYP1A2CYP2D6MGLLTRPV1
SCHEMBL14979619 0.84 FAAH (0.51) FAAHCYP1A2
SCHEMBL16866583 0.83 FAAH (0.48) FAAH
SCHEMBL17082354 0.83 FAAH (0.49) FAAH
SCHEMBL517602 0.81 FAAH (0.54) FAAHCYP1A2CYP2D6MGLLTRPV1
SCHEMBL17074803 0.75 FAAH (0.60) FAAH
SCHEMBL23448755 0.75 GPR119 (0.50) —
SCHEMBL29845476 0.75 GPR119 (0.50) —
SCHEMBL14979622 0.74 FAAH (0.59) FAAH

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12246014-B2 Azetidine derivatives LIGAND UK DEVELOPMENT LIMITED (GB) 2025-03-11 — — US disclosed
US-10918640-B2 Azetidine derivatives VERNALIS (R&D) LTD. (GB) 2021-02-16 — — US disclosed
US-10383871-B2 Azetidine derivatives VERNALIS (R&D) LTD. (GB) 2019-08-20 — — US disclosed
US-20170196864-A1 Azetidine Derivatives VERNALIS DEVELOPMENT LIMITED (GB) 2017-07-13 — — US disclosed
US-20170196864-A1 Azetidine Derivatives VERNALIS DEVELOPMENT LIMITED (GB) 2017-07-13 — — US disclosed
US-9475800-B2 Azetidine derivatives VERNALIS (R&D) LTD. (GB) 2016-10-25 — — US disclosed
US-9475800-B2 Azetidine derivatives VERNALIS (R&D) LTD. (GB) 2016-10-25 — — US disclosed
EP-2265578-B1 AZETIDINE DERIVATIVES VERNALIS R&D LTD (GB) 2015-09-16 — — EP disclosed
EP-2265578-B1 AZETIDINE DERIVATIVES VERNALIS R&D LTD (GB) 2015-09-16 — — EP disclosed
US-20150183769-A1 Azetidine Derivatives VERNALIS DEVELOPMENT LIMITED (GB) 2015-07-02 — — US disclosed
US-20150183769-A1 Azetidine Derivatives VERNALIS DEVELOPMENT LIMITED (GB) 2015-07-02 — — US disclosed
US-9006269-B2 Azetidine derivatives VERNALIS (R&D) LTD. (GB) 2015-04-14 — — US disclosed
US-9006269-B2 Azetidine derivatives VERNALIS (R&D) LTD. (GB) 2015-04-14 — — US disclosed
US-20130331371-A1 Azetidine Derivatives VERNALIS (R&D) LTD. (GB) 2013-12-12 — — US disclosed
US-8450346-B2 Azetidine derivatives as FAAH inhibitors VERNALIS (R&D) LTD. (GB) 2013-05-28 — — US disclosed
US-8450346-B2 Azetidine derivatives as FAAH inhibitors VERNALIS (R&D) LTD. (GB) 2013-05-28 — — US disclosed
US-20120028953-A1 Azetidine Derivatives VERNALIS (R&D) LTD. (GB) 2012-02-02 — — US disclosed
US-20120028953-A1 Azetidine Derivatives VERNALIS (R&D) LTD. (GB) 2012-02-02 — — US disclosed
EP-2265578-A1 AZETIDINE DERIVATIVES Vernalis (R&D) Ltd. (GB) 2010-12-29 — — EP disclosed
WO-2009109743-A1 AZETIDINE DERIVATIVES VERNALIS (R&D) LTD. (GB) 2009-09-11 — — 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 (7 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-10918640-B2 Azetidine derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 35/4885CYP2D6 105/4885
US-20130331371-A1 Azetidine Derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 38/4885CYP2D6 119/4885
US-12246014-B2 Azetidine derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 44/4885CYP2D6 133/4885
US-20120028953-A1 Azetidine Derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 42/4885CYP2D6 130/4885
US-20150183769-A1 Azetidine Derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 38/4885CYP2D6 119/4885
US-20170196864-A1 Azetidine Derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 35/4885CYP2D6 105/4885
US-10383871-B2 Azetidine derivatives FAAH2, FAAH, APEH FAAH 2/4885CYP1A2 35/4885CYP2D6 105/4885

“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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