SCHEMBL25898141

SCHEMBL25898141

CC1(C)OB(c2ccc3c(c2)CC(CO[Si](C)(C)C(C)(C)C)O3)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
BACE1 P56817 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
HRH3 Q9Y5N1 4/20 0.34
DGAT1 O75907 1/20 0.32
LPL P06858 3/20 0.32
LIPG Q9Y5X9 3/20 0.32
TOP2A P11388 3/20 0.31
AAK1 Q2M2I8 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HIF1A Q16665 1/20 0.31
ROCK1 Q13464 1/20 0.30
FFAR1 O14842 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
SCHEMBL23564249 0.83 HRH3 (0.38) BACE1BACE2HRH3LPLLIPG
SCHEMBL27182499 0.82 LPL (0.35) PRMT5WDR77BACE1BACE2HRH3
SCHEMBL29804053 0.77 GLS (0.39) HRH3TOP2AHRH4
SCHEMBL23533600 0.77 GLS (0.39) HRH3TOP2AHRH4
SCHEMBL30051494 0.74 LPL (0.36) PRMT5WDR77BACE1BACE2LPL
SCHEMBL31316806 0.74 HRH3 (0.36) HRH3TOP2AHRH4
SCHEMBL6287405 0.73 CA2 (0.36) BACE1LPLLIPGHIF1AROCK1
SCHEMBL31394338 0.73 TDP1 (0.47) LPLLIPGROCK1
SCHEMBL29175434 0.72 HRH3 (0.48) HRH3LPLLIPGHRH4ROCK1
SCHEMBL3289662 0.71 TOP2A (0.35) HRH3TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702409-B2 Pyrazolyl derivatives useful as anti-cancer agents NOVARTIS AG (CH) 2023-07-18 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-11702409-B2 Pyrazolyl derivatives useful as anti-cancer agents PAK5, CYP51A1, SF3B5 PRMT5 589/4885WDR77 2040/4885BACE1 2407/4885

“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.