SCHEMBL4226632

SCHEMBL4226632

O=C(NC1CCOc2ccccc21)C(=O)NC1CCOc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.54
▸ MAPK1 P28482 7/20 0.50
▸ CNR1 P21554 1/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ BRD4 O60885 2/20 0.47
▸ CREBBP Q92793 2/20 0.47
▸ XIAP P98170 1/20 0.44
▸ SSTR4 P31391 1/20 0.43

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
SCHEMBL4226634 1.00 TRPV1 (0.54) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL27125516 0.88 TRPV1 (0.50) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL26962614 0.88 TRPV1 (0.50) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL599782 0.87 TRPV1 (0.49) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL20622055 0.87 TRPV1 (0.49) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL803487 0.87 TRPV1 (0.49) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL14452760 0.87 TRPV1 (0.49) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL31316828 0.87 TRPV1 (0.49) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL14277888 0.87 TRPV1 (0.49) TRPV1MAPK1CNR1CNR2BRD4
SCHEMBL13131121 0.84 HTT (0.57) TRPV1CNR1CNR2BRD4CREBBP

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
EP-2096104-A1 Organic diamines as mGluR7 modulators Novartis AG (CH) 2009-09-02 — — EP disclosed
US-20080242698-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-02 — — 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-20080242698-A1 Organic Compounds AOC1, OTC, ODC1 TRPV1 780/4885MAPK1 2302/4885CNR1 3533/4885

“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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