SCHEMBL20164617

SCHEMBL20164617

CCNc1nc(Cl)nc2c(NCCCO)nc(Cl)nc12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 5/20 0.47
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.40
PGK1 P00558 3/20 0.38
HTT P42858 1/20 0.38
ADORA3 P0DMS8 3/20 0.36
ADORA1 P30542 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
RAD52 P43351 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL20164645 0.90 SLC29A1 (0.51) SLC29A1KMT2AHTTHDAC1HDAC2
SCHEMBL20164569 0.85 SLC29A1 (0.41) SLC29A1KMT2ALMNAHTTADORA3
SCHEMBL16094623 0.84 LMNA (0.54) KMT2ALMNAPGK1ADORA3ADORA1
SCHEMBL20164638 0.79 SLC29A1 (0.54) SLC29A1KMT2ALMNAHTTHDAC1
SCHEMBL20164633 0.79 SLC29A1 (0.58) SLC29A1KMT2ATLR8TLR7POLB
Hydrochloric Acid SCHEMBL20164454 0.78 SLC29A1 (0.56) SLC29A1TLR8TLR7POLBRAD52
SCHEMBL10005092 0.77 KMT2A (0.54) SLC29A1KMT2ALMNAHDAC1HDAC2
SCHEMBL16094375 0.76 SLC29A1 (0.47) SLC29A1KMT2ALMNAHDAC1HDAC2
SCHEMBL20164431 0.76 SLC29A1 (0.46) SLC29A1KMT2AHTTPOLB
SCHEMBL17494542 0.75 LMNA (0.61) SLC29A1KMT2ALMNAPGK1ADORA3

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 SLC29A1 4472/4885KMT2A 2456/4885LMNA 1394/4885
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same MTNR1B, PDE3A, CHRM3 SLC29A1 4518/4885KMT2A 2528/4885LMNA 1200/4885

“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.