SCHEMBL21722290

SCHEMBL21722290

Cc1ccc2c(c1C1CCCC(=O)C1)COC2

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
CES1 P23141 1/20 0.32
ESR2 Q92731 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL30834503 0.72 GRM7 (0.32)
SCHEMBL21722189 0.72 GRM7 (0.32)
SCHEMBL21722423 0.70 ALDH1A1 (0.41) MAPTALDH1A1
SCHEMBL14529987 0.69 MAPT (0.44) MAPTESR2ALDH1A1
SCHEMBL28608577 0.65 HTR2C (0.47) MAPTALDH1A1
SCHEMBL21733468 0.65 HTR1A (0.44) MAPTALDH1A1
SCHEMBL2044812 0.65 PRKCG (0.36) MAPTALDH1A1
SCHEMBL714856 0.64 ESR2 (0.50) MAPTESR2ALDH1A1
SCHEMBL13259272 0.64 KDM4E (0.36) MAPTALDH1A1
SCHEMBL715958 0.64 CHRM2 (0.45) MAPTESR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112119075-B Condensed ring compound 豪夫迈·罗氏有限公司 2024-03-12 CN disclosed
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
US-11760744-B2 Fused ring compounds GENENTECH, INC. (US) 2023-09-19 US disclosed
US-20230002345-A1 FUSED RING COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-05 US disclosed
CN-112119075-A Fused ring compound 豪夫迈·罗氏有限公司 2020-12-22 CN disclosed
EP-3746436-A1 FUSED RING COMPOUNDS F. Hoffmann-La Roche AG (CH) 2020-12-09 EP disclosed
WO-2020035031-A1 FUSED RING COMPOUNDS GENENTECH, INC. (US) 2020-02-20 WO disclosed
WO-2020035031-A1 FUSED RING COMPOUNDS GENENTECH, INC. (US) 2020-02-20 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 (2 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-11760744-B2 Fused ring compounds KRAS, NRAS, HRAS MAPT 3269/4885CES1 3100/4885ESR2 335/4885
US-20230002345-A1 FUSED RING COMPOUNDS KRAS, NRAS, HRAS MAPT 3269/4885CES1 3100/4885ESR2 335/4885

“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.