SCHEMBL21033716

SCHEMBL21033716

Cn1cc(-c2cnc3nc(C(=O)O)cn3c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 4/20 0.46
CDK8 P49336 4/20 0.46
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
CHEK1 O14757 2/20 0.43
MAP4K4 O95819 1/20 0.41
FGFR2 P21802 3/20 0.40
FGFR3 P22607 3/20 0.40
FGFR1 P11362 2/20 0.39
MAPK1 P28482 2/20 0.39
AURKB Q96GD4 2/20 0.39
FGFR4 P22455 1/20 0.39
KDR P35968 1/20 0.39
GRM2 Q14416 1/20 0.39
USP30 Q70CQ3 1/20 0.39
CHEK2 O96017 1/20 0.39
ABL1 P00519 2/20 0.38
GSK3B P49841 2/20 0.38
DYRK1A Q13627 2/20 0.38
WNT1 P04628 1/20 0.38

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
SCHEMBL30845793 0.87 CCNC (0.48) CCNCCDK8PIM1PIM2FGFR2
SCHEMBL21033491 0.82 KDM4E (0.55) CHEK1FGFR2FGFR3FGFR1FGFR4
SCHEMBL21033166 0.79 USP30 (0.55) CCNCCDK8PIM1PIM2CHEK1
SCHEMBL23534294 0.79 PORCN (0.38) ABL1
SCHEMBL3500124 0.77 GRM5 (0.53) MAP4K4
SCHEMBL21033208 0.77 PIK3C3 (0.40)
SCHEMBL2108962 0.76 CCNC (0.56) CCNCCDK8PIM1PIM2CHEK1
SCHEMBL23553891 0.75 RXFP1 (0.43)
SCHEMBL21033340 0.75 CHEK1 (0.47) CCNCCDK8PIM1PIM2CHEK1
SCHEMBL23571979 0.73 PTGS1 (0.41)

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 CCNC 1286/4885CDK8 273/4885PIM1 129/4885

“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.