SCHEMBL20164544

SCHEMBL20164544

CNc1nc(NC[C@H](C)O)nc2c(NC)nc(Cl)nc12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 4/20 0.40
CDK2 P24941 5/20 0.37
CCNE1 P24864 3/20 0.37
FLT3 P36888 3/20 0.36
CDK1 P06493 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CDK9 P50750 2/20 0.34
CDK7 P50613 1/20 0.34
CDK5 Q00535 1/20 0.34
LMNA P02545 1/20 0.33
P2RY1 P47900 1/20 0.33
GAA P10253 1/20 0.33
YTHDF3 Q7Z739 1/20 0.33
YTHDF1 Q9BYJ9 1/20 0.33
YTHDF2 Q9Y5A9 1/20 0.33

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
SCHEMBL30560041 1.00 YTHDC1 (0.40) YTHDC1CDK2CCNE1FLT3CDK1
SCHEMBL20164329 1.00 YTHDC1 (0.40) YTHDC1CDK2CCNE1FLT3CDK1
SCHEMBL20164331 1.00 YTHDC1 (0.40) YTHDC1CDK2CCNE1FLT3CDK1
SCHEMBL20164458 0.87 LMNA (0.43) CDK2CCNE1FLT3CDK1SMN1; SMN2
SCHEMBL30560026 0.87 LMNA (0.43) CDK2CCNE1FLT3CDK1SMN1; SMN2
SCHEMBL20164461 0.87 LMNA (0.43) CDK2CCNE1FLT3CDK1SMN1; SMN2
SCHEMBL20164621 0.87 LMNA (0.43) CDK2CCNE1FLT3CDK1SMN1; SMN2
SCHEMBL20164425 0.85 YTHDC1 (0.38) YTHDC1CDK1SMN1; SMN2LMNAP2RY1
SCHEMBL30560025 0.85 YTHDC1 (0.41) YTHDC1CDK2CCNE1SMN1; SMN2CDK9
SCHEMBL20164377 0.85 YTHDC1 (0.41) YTHDC1CDK2CCNE1SMN1; SMN2CDK9

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-3316890-B1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF MAKING AND USING SAME NEURAD LTD (IL) 2023-09-06 EP disclosed
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same NEURAD LTD. (IL) 2019-05-21 US disclosed
US-20180141953-A1 Novel Breathing Control Modulating Compounds, and Methods of Making and Using Same NEURAD LTD. (IL) 2018-05-24 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 (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-20180141953-A1 Novel Breathing Control Modulating Compounds, and Methods of Making and Using Same MTNR1B, CHRM3, PER2 YTHDC1 2024/4885CDK2 4026/4885CCNE1 4167/4885
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same MTNR1B, PDE3A, CHRM3 YTHDC1 2085/4885CDK2 4190/4885CCNE1 4321/4885

“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.