SCHEMBL21733731

SCHEMBL21733731

Cc1cc2c(ncn2COCC[Si](C)(C)C)c(C2CCc3c(ncnc3N3CCNCC3)C2)c1C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.36
TLR7 Q9NYK1 1/20 0.35
PIK3CD O00329 1/20 0.30

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
SCHEMBL21722198 0.86 KRAS (0.40)
SCHEMBL30834545 0.86 KRAS (0.40)
SCHEMBL21722186 0.80 HPRT1 (0.33)
SCHEMBL30834485 0.80 HPRT1 (0.33)
SCHEMBL28496519 0.77 KRAS (0.45)
SCHEMBL30834566 0.77 KRAS (0.45)
SCHEMBL21734010 0.76 KRAS (0.37) HTR2CTLR7
SCHEMBL21722274 0.70 DGAT1 (0.39)
SCHEMBL21722231 0.67 KRAS (0.41) HTR2CTLR7
SCHEMBL21734011 0.67 KRAS (0.41) HTR2CTLR7

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
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
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 HTR2C 4653/4885TLR7 4639/4885PIK3CD 506/4885
US-20230002345-A1 FUSED RING COMPOUNDS KRAS, NRAS, HRAS HTR2C 4653/4885TLR7 4639/4885PIK3CD 506/4885

“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.