SCHEMBL19633609

SCHEMBL19633609

CCc1ncnc(NC2CCOCC2)c1C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 6/20 0.47
MAPK1 P28482 3/20 0.45
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
CSF1R P07333 2/20 0.41
LRRK2 Q5S007 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CD38 P28907 1/20 0.41
ADORA3 P0DMS8 3/20 0.41
ADORA2A P29274 3/20 0.41
ADORA2B P29275 3/20 0.41
ADORA1 P30542 3/20 0.41
EGFR P00533 1/20 0.39

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
SCHEMBL15834058 0.85 ADORA3 (0.37) IRAK4JAK2JAK1KDM4ECD38
SCHEMBL15829840 0.81 IRAK4 (0.51) IRAK4MAPK1JAK2JAK1CSF1R
SCHEMBL31498503 0.77 MAPK1 (0.49) IRAK4MAPK1JAK2JAK1LRRK2
SCHEMBL16217391 0.77 IRAK4 (0.47) IRAK4MAPK1JAK2JAK1CSF1R
SCHEMBL16091455 0.77 MAPK1 (0.49) IRAK4MAPK1JAK2JAK1CSF1R
SCHEMBL17308604 0.69 MAPK1 (0.43) IRAK4MAPK1CSF1RLRRK2KDM4E
SCHEMBL15834739 0.69 KDM4E (0.36) IRAK4JAK2JAK1KDM4EADORA3
SCHEMBL19287695 0.69 KDM4E (0.36) IRAK4JAK2JAK1KDM4EADORA3
SCHEMBL9061374 0.68 KDM4E (0.37) IRAK4KDM4E
SCHEMBL29944842 0.68 EML4 (0.44) MAPK1

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-10307413-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2019-06-04 US disclosed
US-20170334861-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-11-23 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-10307413-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof PRMT5, PRMT1, PRMT3 IRAK4 1567/4885MAPK1 1357/4885JAK2 450/4885
US-20170334861-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 IRAK4 1567/4885MAPK1 1357/4885JAK2 450/4885

“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.