SCHEMBL21033340

SCHEMBL21033340

Cn1cc(-c2cn3cc(C(=O)O)nc3cn2)cn1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.47
FYN P06241 6/20 0.44
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
IRAK4 Q9NWZ3 2/20 0.40
STING1 Q86WV6 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
USP30 Q70CQ3 2/20 0.38
GRM2 Q14416 1/20 0.38
MAP4K4 O95819 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
KDM5B Q9UGL1 1/20 0.37

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
SCHEMBL30845766 0.88 CLK1 (0.46) CHEK1FYNCCNCCDK8IRAK4
SCHEMBL30828852 0.88 GRM2 (0.44) CHEK1FYNCCNCCDK8IRAK4
SCHEMBL21014297 0.83 KDM4E (0.50) CHEK1FYNUSP30
SCHEMBL21033166 0.80 USP30 (0.55) CHEK1CCNCCDK8PTGS1PTGS2
SCHEMBL21033173 0.78 DYRK1A (0.43) PTGS1PTGS2
SCHEMBL10328709 0.77 CHEK1 (0.50) CHEK1FYNCCNCCDK8IRAK4
SCHEMBL21033307 0.76 PTGS1 (0.41) PTGS1PTGS2PIM1HRH4
SCHEMBL21033596 0.76 PIK3CG (0.51) CHEK1FYNCCNCCDK8IRAK4
SCHEMBL21033716 0.75 CCNC (0.46) CHEK1CCNCCDK8PIM1PIM2
SCHEMBL21033324 0.75 PTGS1 (0.49) PTGS1PTGS2HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210371431-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT EPISCRIBE LLC 2021-12-02 US disclosed
WO-2019102494-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT BIOSYS LIMITED (IN) 2019-05-31 WO 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-20210371431-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 CHEK1 527/4885FYN 757/4885CCNC 1286/4885

“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.