SCHEMBL20164625

SCHEMBL20164625

CC[C@@H](C)Nc1nc(NC)c2nc(Cl)nc(NC)c2n1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 5/20 0.41
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
TP53 P04637 1/20 0.38
GLP1R P43220 1/20 0.36
ATM Q13315 1/20 0.34
PDE4A P27815 3/20 0.34
YTHDF3 Q7Z739 2/20 0.33
YTHDF1 Q9BYJ9 2/20 0.33
YTHDF2 Q9Y5A9 2/20 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
SCHEMBL20164731 1.00 YTHDC1 (0.41) YTHDC1ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL20164684 0.78 YTHDC1 (0.41) YTHDC1GAATDP1YTHDF3YTHDF1
SCHEMBL30560022 0.78 YTHDC1 (0.41) YTHDC1GAATDP1YTHDF3YTHDF1
SCHEMBL20164508 0.78 MEN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1GAA
SCHEMBL20164679 0.78 MEN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1GAA
SCHEMBL20164542 0.78 MEN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1GAA
SCHEMBL20164351 0.78 MEN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1GAA
SCHEMBL20164354 0.78 MEN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1GAA
SCHEMBL11044268 0.77 GAA (0.56) ALDH1A1MEN1KMT2AL3MBTL1GAA
Hydrochloric Acid SCHEMBL20164780 0.77 MEN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1GAA

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 2024/4885ALDH1A1 2164/4885MEN1 2683/4885
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same MTNR1B, PDE3A, CHRM3 YTHDC1 2085/4885ALDH1A1 2004/4885MEN1 2347/4885

“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.