SCHEMBL20165828

SCHEMBL20165828

O=C(O)N1CC(Oc2cc(F)c(F)cc2F)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 7/20 0.40
RIPK1 Q13546 2/20 0.37
CHRM3 P20309 1/20 0.34
PDE9A O76083 1/20 0.34
OXTR P30559 3/20 0.34
GRIN1 Q05586 2/20 0.33
GRIN2B Q13224 2/20 0.33
SCN9A Q15858 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL4213774 0.80 RBP4 (0.41) RBP4RIPK1CHRM3OXTRGRIN1
SCHEMBL20165934 0.80 MAPK1 (0.36) RBP4RIPK1
SCHEMBL20165480 0.80 OXTR (0.41) RBP4RIPK1OXTRGRIN1GRIN2B
SCHEMBL22817811 0.79 GPR119 (0.48) SCN9A
SCHEMBL23365192 0.78 GRIN1 (0.48) RIPK1GRIN1GRIN2BSCN9AKCNH2
SCHEMBL20165896 0.78 RBP4 (0.41) RBP4RIPK1CHRM3PDE9AOXTR
SCHEMBL23830674 0.77 HRH3 (0.39) RBP4RIPK1
SCHEMBL20165827 0.77 RIPK1 (0.38) RBP4RIPK1
SCHEMBL20165884 0.77 RIPK1 (0.38) RBP4RIPK1OXTRGRIN1GRIN2B
SCHEMBL20165925 0.75 CES2 (0.35) RBP4RIPK1GRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541784-B1 NOVEL AZETIDINE DERIVATIVES USEFUL AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION INTEGRATIVE RES LABORATORIES SWEDEN AB (SE) 2023-09-13 EP disclosed
US-10875829-B1 Azetidine derivatives useful as modulators of cortical catecholaminergic neurotransmission INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2020-12-29 US disclosed
EP-3541784-A1 NOVEL AZETIDINE DERIVATIVES USEFUL AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION Integrative Research Laboratories Sweden AB (SE) 2019-09-25 EP disclosed
WO-2018091687-A1 NOVEL AZETIDINE DERIVATIVES USEFUL AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 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 (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-10875829-B1 Azetidine derivatives useful as modulators of cortical catecholaminergic neurotransmission SLC18A1, CHRM1, CHRM2 RBP4 4261/4885RIPK1 4852/4885CHRM3 20/4885

“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.