SCHEMBL23926326

SCHEMBL23926326

COc1ccccc1CCN1CCOCC1

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.79
KCNH2 Q12809 2/20 0.77
HRH3 Q9Y5N1 1/20 0.74
CYP2D6 P10635 1/20 0.57
TSHR P16473 1/20 0.57
DRD2 P14416 1/20 0.56
HTR2B P41595 1/20 0.56
CNR1 P21554 1/20 0.55

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
SCHEMBL30118894 1.00 SIGMAR1 (0.79) SIGMAR1KCNH2HRH3CYP2D6TSHR
SCHEMBL30118922 0.91 SIGMAR1 (0.65) SIGMAR1KCNH2HRH3CYP2D6TSHR
SCHEMBL23926367 0.91 SIGMAR1 (0.65) SIGMAR1KCNH2HRH3CYP2D6TSHR
SCHEMBL14514792 0.84 CYP2A13 (0.63) SIGMAR1CYP2D6TSHRDRD2HTR2B
SCHEMBL10782490 0.83 CYP2A13 (0.61) SIGMAR1CYP2D6TSHRDRD2HTR2B
SCHEMBL8672312 0.81 SIGMAR1 (0.79) SIGMAR1KCNH2HRH3CYP2D6DRD2
SCHEMBL9086865 0.81 SIGMAR1 (0.51) SIGMAR1KCNH2HRH3
SCHEMBL17828187 0.80 SIGMAR1 (0.77) SIGMAR1KCNH2HRH3
SCHEMBL12818306 0.80 SIGMAR1 (0.77) SIGMAR1KCNH2HRH3DRD2HTR2B
SCHEMBL15143993 0.80 SMN1; SMN2 (0.54) SIGMAR1KCNH2HRH3CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4168408-A1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES Alterity Therapeutics Limited (AU) 2023-04-26 EP disclosed
CN-115667256-A Compounds for treating diseases and methods of treating diseases 艾特里提治疗有限公司 2023-01-31 CN disclosed
WO-2021253091-A1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES Alterity Therapeutics Limited (AU) 2021-12-23 WO disclosed
US-11155547-B1 Compounds for and methods of treating diseases Alterity Therapeutics Limited (AU) 2021-10-26 US disclosed
CN-108137518-A As 6 inhibitor of histone deacetylase 1,3,4- oxadiazole derivatives compound and include its pharmaceutical composition 株式会社钟根堂 2018-06-08 CN 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-11155547-B1 Compounds for and methods of treating diseases HTT, SNCA, PARK7 SIGMAR1 3913/4885KCNH2 3907/4885HRH3 558/4885

“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.