SCHEMBL17830246

SCHEMBL17830246

CC(C)(C)N1CCC(n2ccc3c(N)ncnc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
PRMT5 O14744 10/20 0.45
WDR77 Q9BQA1 9/20 0.45
ADK P55263 1/20 0.42
ADORA2A P29274 4/20 0.40
METTL3 Q86U44 1/20 0.40
ADORA3 P0DMS8 2/20 0.39
ADORA1 P30542 2/20 0.39
PI4KA P42356 2/20 0.39
PI4K2B Q8TCG2 2/20 0.39
PI4K2A Q9BTU6 2/20 0.39
PI4KB Q9UBF8 2/20 0.39
ADORA2B P29275 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
SCHEMBL10242174 0.82 ADORA2A (0.56) MEN1PRMT5WDR77ADKADORA2A
SCHEMBL17818386 0.80 MEN1 (0.48) MEN1PRMT5WDR77ADK
SCHEMBL16237556 0.80 SRC (0.48) MEN1PRMT5WDR77ADKADORA2A
SCHEMBL16254799 0.79 GPR119 (0.59) MEN1PRMT5WDR77
SCHEMBL16236292 0.78 MEN1 (0.50) MEN1PRMT5WDR77ADKADORA2A
SCHEMBL16254729 0.78 METTL3 (0.53) MEN1PRMT5WDR77ADKADORA2A
SCHEMBL2740574 0.76 ADK (0.48) MEN1PRMT5WDR77ADK
SCHEMBL14447403 0.76 MEN1 (0.43) MEN1PRMT5WDR77ADKADORA2A
SCHEMBL17818398 0.75 MAP4K4 (0.49) MEN1PRMT5WDR77ADK
SCHEMBL13314384 0.71 ADK (0.53) MEN1PRMT5WDR77ADKMETTL3

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-9682083-B2 Pyrrolo[2,3-D]pyrimidine derivatives, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-06-20 US disclosed
US-20160166575-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-06-16 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-20160166575-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS RET, DCK, PRKD2 MEN1 3235/4885PRMT5 188/4885WDR77 1085/4885

“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.