SCHEMBL23326115

SCHEMBL23326115

COc1cc(C2=CCCN(C(=O)OC(C)(C)C)C2)c(OC2CC2)cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.45
WDR5 P61964 2/20 0.42
PDE4D Q08499 5/20 0.42
PDE4A P27815 4/20 0.42
PDE4C Q08493 4/20 0.42
EPHX2 P34913 1/20 0.41
GPR119 Q8TDV5 2/20 0.39

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
SCHEMBL30669762 0.91 WDR5 (0.44) PDE4BWDR5EPHX2GPR119
SCHEMBL28782708 0.88 HTR2A (0.38) PDE4BPDE4DEPHX2
SCHEMBL29775402 0.88 HTR2A (0.38) PDE4BPDE4DEPHX2
SCHEMBL31358051 0.78 ESR2 (0.39) PDE4BWDR5PDE4DPDE4APDE4C
SCHEMBL23326161 0.77 HTR2A (0.56) PDE4BPDE4DPDE4APDE4C
SCHEMBL30473751 0.75 WDR5 (0.42) WDR5EPHX2GPR119
SCHEMBL25430944 0.75 WDR5 (0.42) WDR5EPHX2GPR119
SCHEMBL15595098 0.73 PDK4 (0.47) PDE4BGPR119
SCHEMBL25276830 0.72 DGAT2 (0.49) GPR119
SCHEMBL18686588 0.70 TBK1 (0.42) PDE4BPDE4DPDE4APDE4CGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114761083-B 5-HT for treating depression 2A Agonists 罗福拉公司 2024-02-13 CN disclosed
EP-3962601-B1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2023-05-31 EP disclosed
US-11642336-B2 5-HT2A agonists for use in treatment of depression Lophora ApS (DK) 2023-05-09 US disclosed
US-11633390-B2 5-HT2A agonists for use in treatment of depression Lophora ApS (DK) 2023-04-25 US disclosed
CN-114761083-A 5-HT for the treatment of depression2AAgonists 罗福拉公司 2022-07-15 CN disclosed
US-20220062257-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2022-03-03 US disclosed
US-11246860-B2 5-HT2A agonists for use in treatment of depression Lophora ApS (DK) 2022-02-15 US disclosed
US-20210330658-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2021-10-28 US disclosed
US-20210137908-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION Lophora ApS (DK) 2021-05-13 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 (6 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-20210330658-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION HTR2A, HTR2C, HTR5A PDE4B 461/4885WDR5 2558/4885PDE4D 308/4885
US-20220062257-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION HTR2A, HTR2C, HTR5A PDE4B 461/4885WDR5 2558/4885PDE4D 308/4885
US-11642336-B2 5-HT2A agonists for use in treatment of depression HTR2A, HTR2C, HTR5A PDE4B 461/4885WDR5 2558/4885PDE4D 308/4885
US-20210137908-A1 5-HT2A AGONISTS FOR USE IN TREATMENT OF DEPRESSION HTR2A, HTR2C, HTR5A PDE4B 461/4885WDR5 2558/4885PDE4D 308/4885
US-11633390-B2 5-HT2A agonists for use in treatment of depression HTR2A, HTR2C, HTR5A PDE4B 461/4885WDR5 2558/4885PDE4D 308/4885
US-11246860-B2 5-HT2A agonists for use in treatment of depression HTR2A, HTR2C, HTR5A PDE4B 461/4885WDR5 2558/4885PDE4D 308/4885

“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.