SCHEMBL20164461

SCHEMBL20164461

CCNc1nc(NCC(C)O)nc2c(NCC)nc(Cl)nc12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.40
CDK2 P24941 5/20 0.38
CCNE1 P24864 3/20 0.38
CDK1 P06493 3/20 0.38
SLC29A1 Q99808 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FLT3 P36888 3/20 0.36
CDK9 P50750 2/20 0.35
CDK7 P50613 1/20 0.35
CDK5 Q00535 1/20 0.35
PGK1 P00558 2/20 0.35
ADORA3 P0DMS8 2/20 0.34
ADORA1 P30542 1/20 0.34

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
SCHEMBL30560026 1.00 LMNA (0.43) LMNAGAACDK2CCNE1CDK1
SCHEMBL20164621 1.00 LMNA (0.43) LMNAGAACDK2CCNE1CDK1
SCHEMBL20164458 1.00 LMNA (0.43) LMNAGAACDK2CCNE1CDK1
SCHEMBL20164389 0.89 CDK2 (0.42) LMNAGAACDK2CCNE1CDK1
SCHEMBL20164392 0.89 CDK2 (0.42) LMNAGAACDK2CCNE1CDK1
SCHEMBL20164663 0.89 CDK2 (0.42) LMNAGAACDK2CCNE1CDK1
Hydrochloric Acid SCHEMBL20164438 0.88 CDK2 (0.41) LMNAGAACDK2CCNE1CDK1
Hydrochloric Acid SCHEMBL20164441 0.88 CDK2 (0.41) LMNAGAACDK2CCNE1CDK1
Hydrochloric Acid SCHEMBL20164619 0.88 CDK2 (0.41) LMNAGAACDK2CCNE1CDK1
SCHEMBL20164329 0.87 YTHDC1 (0.40) LMNAGAACDK2CCNE1CDK1

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 LMNA 1394/4885GAA 1936/4885CDK2 4026/4885
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same MTNR1B, PDE3A, CHRM3 LMNA 1200/4885GAA 1576/4885CDK2 4190/4885

“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.