SCHEMBL20164565

SCHEMBL20164565

CNc1nc(N(C)C2CC2)nc2c(NC)nc(NCCO)nc12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 13/20 0.45
CDK1 P06493 1/20 0.42
MAPK1 P28482 2/20 0.36
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.33
IKBKB O14920 1/20 0.33
HRH4 Q9H3N8 1/20 0.32

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
Hydrochloric Acid SCHEMBL20164306 0.99 SLC29A1 (0.44) SLC29A1CDK1MAPK1MEN1GAA
SCHEMBL20164783 0.84 SLC29A1 (0.51) SLC29A1CDK1MAPK1MEN1GAA
SCHEMBL20164460 0.84 CDK2 (0.35) SLC29A1CDK1
SCHEMBL20164480 0.84 CDK2 (0.35) SLC29A1CDK1
Hydrochloric Acid SCHEMBL20164738 0.82 FLT3 (0.34) SLC29A1CDK1
Hydrochloric Acid SCHEMBL20164432 0.82 FLT3 (0.34) SLC29A1CDK1
Hydrochloric Acid SCHEMBL20164622 0.82 SLC29A1 (0.50) SLC29A1CDK1MAPK1MEN1GAA
SCHEMBL20164686 0.81 JAK2 (0.31)
Hydrochloric Acid SCHEMBL20164746 0.80 JAK2 (0.30)
SCHEMBL20164353 0.80 CDK1 (0.47) SLC29A1CDK1MAPK1ALDH1A1IKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180141953-A1 Novel Breathing Control Modulating Compounds, and Methods of Making and Using Same NEURAD LTD. (IL) 2018-05-24 US claimed
US-20250057848-A1 GAL475 COMPOSITIONS AND METHODS OF USE THEREOF NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2025-02-20 US disclosed
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 (3 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 SLC29A1 4472/4885CDK1 3077/4885MAPK1 4681/4885
US-20250057848-A1 GAL475 COMPOSITIONS AND METHODS OF USE THEREOF GPR119, GPR35, GPR55 SLC29A1 2077/4885CDK1 3085/4885MAPK1 3271/4885
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same MTNR1B, PDE3A, CHRM3 SLC29A1 4518/4885CDK1 3444/4885MAPK1 4702/4885

“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.