SCHEMBL11242408

SCHEMBL11242408

COc1cccc2c1CC1(CCCCC1)C2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.45
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
TOP1 P11387 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 1/20 0.38
ADRA2A P08913 1/20 0.37
HTR1A P08908 1/20 0.37
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL15692718 0.98 ACHE (0.46) ACHECA1CA2CA7CA9
SCHEMBL15692861 0.95 ACHE (0.46) ACHECA1CA2CA7CA9
SCHEMBL15692838 0.92 ACHE (0.49) ACHECA1CA2CA7CA9
SCHEMBL25230970 0.87 HTR2A (0.46) ACHECA1CA2CA7CA9
SCHEMBL25713331 0.81 ABCB1 (0.43) HTR2AHTR2CHTR2BHTR1APOLB
SCHEMBL15692719 0.80 ACHE (0.40) ACHECA1CA2HTR2AHTR2C
SCHEMBL11167244 0.79 ACHE (0.45) ACHECA1CA2CA7CA9
SCHEMBL15692779 0.78 KDM4E (0.49) ACHECA1CA2CA7CA9
SCHEMBL28722035 0.78 NOTUM (0.40) ACHECA1CA2CA7CA9
SCHEMBL15746305 0.78 ALDH1A1 (0.42) ACHECA1CA2CA7CA9

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
US-11685748-B2 Spiro aromatic ring compound and application thereof ETERN BIOPHARMA (SHANGHAI) CO., LTD. (CN) 2023-06-27 US disclosed
US-4322437-A Spiro substituted indanones and tetralones SANDOZ LTD. (CH) 1982-03-30 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-11685748-B2 Spiro aromatic ring compound and application thereof PTPN1, PTPN11, PTPN5 ACHE 4389/4885CA1 2126/4885CA2 1174/4885

“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.