SCHEMBL26317575

SCHEMBL26317575

Cc1ccc(Nc2nc(N)nc(CN3Cc4ccccc4C3)n2)cc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.72
GAA P10253 2/20 0.72
MAPK1 P28482 7/20 0.70
L3MBTL1 Q9Y468 4/20 0.70
KDM4E B2RXH2 5/20 0.69
HTT P42858 4/20 0.69
ALDH1A1 P00352 6/20 0.67
USP2 O75604 5/20 0.65
MAPT P10636 4/20 0.65
TDP1 Q9NUW8 4/20 0.65
LMNA P02545 2/20 0.62
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
JAK2 O60674 1/20 0.59
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYBB P04839 1/20 0.57
NOX5 Q96PH1 1/20 0.57

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
SCHEMBL29645152 0.92 MAPK1 (0.83) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL21530399 0.92 MAPK1 (0.83) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL21530456 0.88 ALDH1A1 (0.70) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL21530421 0.84 SMN1; SMN2 (1.00) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL15662302 0.82 MAPT (0.80) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL29645154 0.81 SMN1; SMN2 (0.62) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL21530783 0.81 SMN1; SMN2 (0.62) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL21530407 0.81 MAPK1 (0.78) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL29621879 0.79 MAPK1 (0.61) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E
SCHEMBL21530418 0.79 MAPK1 (0.61) SMN1; SMN2GAAMAPK1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739072-B2 Heteroaryl compounds and their use MINORYX THERAPEUTICS S.L. (ES) 2023-08-29 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 (1 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-11739072-B2 Heteroaryl compounds and their use GBA1, GBA2, GAA SMN1; SMN2 36/4885GAA 3/4885MAPK1 4688/4885

“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.