SCHEMBL20176299

SCHEMBL20176299

CCN1CC(Oc2cc(F)cc(F)c2F)C1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.47
OXTR P30559 3/20 0.35
KDM1A O60341 1/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2B Q13224 2/20 0.32

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
SCHEMBL20165889 0.86 SLC6A4 (0.45) SLC6A4
SCHEMBL20166170 0.82 SLC6A4 (0.46) SLC6A4OXTRKDM1AHCRTR1HCRTR2
SCHEMBL20166160 0.82 SLC6A4 (0.41) SLC6A4OXTRKDM1AGRIN1GRIN2B
Hydrochloric Acid SCHEMBL20165897 0.81 SLC6A4 (0.41) SLC6A4OXTRKDM1AGRIN1GRIN2B
SCHEMBL20176661 0.80 SLC6A4 (0.44) SLC6A4OXTRGRIN1GRIN2B
SCHEMBL20165883 0.79 SLC6A4 (0.39) SLC6A4
SCHEMBL20176375 0.78 SLC6A4 (0.55) SLC6A4OXTRGRIN1GRIN2B
SCHEMBL22817831 0.78 SLC6A4 (0.38) SLC6A4OXTRKDM1A
Hydrochloric Acid SCHEMBL20168896 0.78 SLC6A4 (0.38) SLC6A4
SCHEMBL20165492 0.77 SLC6A4 (0.42) SLC6A4GRIN1GRIN2B

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
CN-109963834-B Novel azetidine derivatives useful as modulators of cortical catecholaminergic neurotransmission 综合研究实验室瑞典股份公司 2023-04-14 CN disclosed
US-10875829-B1 Azetidine derivatives useful as modulators of cortical catecholaminergic neurotransmission INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2020-12-29 US 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 SLC6A4 64/4885OXTR 219/4885KDM1A 2048/4885

“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.