SCHEMBL31074656

SCHEMBL31074656

C[Si](C)(C)CCOCn1cc([N+](=O)[O-])c(C(=O)NN)n1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 5/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
MCL1 Q07820 1/20 0.37

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
SCHEMBL22773500 0.88 ALDH1A1 (0.43) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL30079506 0.86 ALDH1A1 (0.43) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL4016651 0.86 ALDH1A1 (0.43) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL26964483 0.82 ALDH1A1 (0.43) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL31074590 0.81 ALDH1A1 (0.37) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL27139104 0.80 ALDH1A1 (0.35) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL30079646 0.79 ALDH1A1 (0.36) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL20338885 0.79 ALDH1A1 (0.34) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL29189600 0.79 L3MBTL1 (0.36) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL30079489 0.78 ALDH1A1 (0.34) L3MBTL1MEN1KMT2ANPC1RAB9A

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 L3MBTL1 3476/4885MEN1 1739/4885KMT2A 1026/4885

“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.