SCHEMBL21064115

SCHEMBL21064115

CC(C)C(C)c1ccnc(NC2CCOCC2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 12/20 0.54
HRH4 Q9H3N8 1/20 0.48
MKNK1 Q9BUB5 2/20 0.46
MKNK2 Q9HBH9 1/20 0.46
MAPK8 P45983 1/20 0.46
MAPK9 P45984 1/20 0.46
MAPK10 P53779 1/20 0.46
RET P07949 1/20 0.46
PIK3C3 Q8NEB9 1/20 0.45
CDK2 P24941 4/20 0.44
CCNT1 O60563 1/20 0.44
CCNC P24863 1/20 0.44
CDK8 P49336 1/20 0.44
CDK7 P50613 1/20 0.44
CDK9 P50750 1/20 0.44
CCNH P51946 1/20 0.44
MNAT1 P51948 1/20 0.44
CCNA2 P20248 3/20 0.41
MAPK3 P27361 3/20 0.41
IDH1 O75874 1/20 0.41

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
SCHEMBL14004978 0.89 MAPK1 (0.57) MAPK1HRH4MKNK1MKNK2MAPK8
SCHEMBL15830033 0.78 MAPK1 (0.62) MAPK1HRH4MKNK1MKNK2MAPK8
SCHEMBL83995 0.77 CDK4 (0.47) HRH4CDK2CDK7CDK9CCNA2
SCHEMBL16220909 0.75 MAPK1 (0.58) MAPK1HRH4MKNK1MKNK2MAPK8
SCHEMBL21064113 0.75 MAPK1 (0.43) MAPK1HRH4MAPK8MAPK9MAPK10
SCHEMBL10188247 0.75 MAPK1 (0.62) MAPK1HRH4MKNK1MKNK2MAPK10
SCHEMBL84414 0.75 CDK1 (0.54) HRH4MKNK2MAPK8MAPK9RET
SCHEMBL19171094 0.74 MAPK1 (0.57) MAPK1HRH4MKNK1MKNK2MAPK8
SCHEMBL24824411 0.74 CCNT1 (0.49) MAPK1MKNK1MKNK2CDK2CCNT1
SCHEMBL84078 0.74 CDK1 (0.56) HRH4MKNK2MAPK8MAPK9RET

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-10307413-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2019-06-04 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-10307413-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof PRMT5, PRMT1, PRMT3 MAPK1 1357/4885HRH4 530/4885MKNK1 345/4885

“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.