SCHEMBL31074609

SCHEMBL31074609

Cc1nn(COCC[Si](C)(C)C)cc1N

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.34
NPC1 O15118 1/20 0.33
KLKB1 P03952 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
SCHEMBL21858181 0.83 DGAT1 (0.35) DGAT1NPC1KLKB1
SCHEMBL24753784 0.83 DGAT1 (0.32) DGAT1NPC1
SCHEMBL21544284 0.83 NPC1 (0.32) DGAT1NPC1
SCHEMBL31074481 0.83 NPC1 (0.32) DGAT1NPC1
SCHEMBL21350803 0.81 DGAT1 (0.39) DGAT1NPC1KLKB1
SCHEMBL28593694 0.81 DGAT1 (0.35) DGAT1NPC1KLKB1
SCHEMBL25414871 0.81 DGAT1 (0.36) DGAT1NPC1KLKB1
SCHEMBL31074692 0.80 ALOX5AP (0.33) DGAT1NPC1
SCHEMBL31074530 0.80 NPC1 (0.31) DGAT1NPC1
SCHEMBL22143711 0.80 FFAR4 (0.36) DGAT1NPC1KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4665734-A1 CYCLIN-DEPENDENT KINASE (CDK2) INHIBITORS Novartis AG (CH) 2025-12-24 EP disclosed
US-20240360137-A1 CYCLIN-DEPENDENT KINASE (CDK2) INHIBITORS NOVARTIS AG (CH) 2024-10-31 US disclosed
WO-2024171094-A1 CYCLIN-DEPENDENT KINASE (CDK2) INHIBITORS NOVARTIS AG (CH) 2024-08-22 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 (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-20240360137-A1 CYCLIN-DEPENDENT KINASE (CDK2) INHIBITORS CDK2, CDK1, CCNK DGAT1 2569/4885NPC1 2825/4885KLKB1 2200/4885

“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.