SCHEMBL784185

SCHEMBL784185

Cc1nc(N)c2c(F)cn(C(C)C)c2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.39
CDK1 P06493 1/20 0.34
CCNB1 P14635 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
ADORA1 P30542 3/20 0.34
ADORA2A P29274 2/20 0.32
ADORA2B P29275 1/20 0.32
PI4KA P42356 1/20 0.32
PI4K2B Q8TCG2 1/20 0.32
PI4K2A Q9BTU6 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
KDR P35968 3/20 0.32
RET P07949 2/20 0.32
DHFR P00374 1/20 0.31
SLC2A1 P11166 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31

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
SCHEMBL19684546 0.78 DYRK1A (0.41) DYRK1AADORA1ADORA2AADORA2BDHFR
SCHEMBL6364419 0.75 PIK3CD (0.51) ADORA1ADORA2AADORA2BPI4KAPI4K2B
SCHEMBL19678821 0.74 SRC (0.37) DYRK1AADORA1ADORA2API4KAPI4K2B
SCHEMBL18520027 0.71 TYMS (0.42) DHFRPIK3CA
SCHEMBL784138 0.70 CDK1 (0.36) CDK1CCNB1CCNE1CDK2ADORA1
SCHEMBL18510343 0.69 PARP1 (0.44) CDK1CCNB1CCNE1CDK2
SCHEMBL15960564 0.68 PIK3CD (0.36) CDK1CCNB1CCNE1CDK2ADORA1
SCHEMBL26357318 0.67 PIK3CD (0.37) ADORA1ADORA2AADORA2BPI4KAPI4K2B
SCHEMBL784159 0.67 CDK2 (0.73) DYRK1ACDK1CCNB1CCNE1CDK2
SCHEMBL10137844 0.66 ADORA2A (0.38) CDK1CCNB1CCNE1CDK2ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264610-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA INC (US) 2016-09-15 US disclosed
US-9346848-B2 Azido nucleosides and nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2016-05-24 US disclosed
US-20150183819-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. 2015-07-02 US disclosed
US-8877731-B2 Azido nucleosides and nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2014-11-04 US disclosed
US-20120070415-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-22 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 (3 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-20160264610-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS PNP, ADA, ADAR DYRK1A 3293/4885CDK1 2336/4885CCNB1 2880/4885
US-20120070415-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS PNP, ADA, ADAR DYRK1A 3293/4885CDK1 2336/4885CCNB1 2880/4885
US-20150183819-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS PNP, ADA, ADAR DYRK1A 3293/4885CDK1 2336/4885CCNB1 2880/4885

“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.