SCHEMBL31074679

SCHEMBL31074679

Cn1ccc(COc2nn(COCC[Si](C)(C)C)cc2[N+](=O)[O-])n1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C9 P11712 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 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
SCHEMBL31074613 0.82 SMN1; SMN2 (0.34) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL31074664 0.82 GRM2 (0.36) GRM2HDAC1HDAC6HDAC5
SCHEMBL31074527 0.81 MEN1 (0.39) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL31074615 0.80 L3MBTL1 (0.34) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL31074719 0.79 SMN1; SMN2 (0.34) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL31074655 0.79 SMN1; SMN2 (0.34) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL31074561 0.79 SMN1; SMN2 (0.34) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL31074598 0.79 SMN1; SMN2 (0.34) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL31074571 0.79 SMN1; SMN2 (0.43) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL31074473 0.78 SMN1; SMN2 (0.37) MEN1KMT2AALDH1A1

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 GRM2 2607/4885HDAC1 629/4885HDAC6 1146/4885

“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.