SCHEMBL17364299

SCHEMBL17364299

CCn1cnc2c(-n3ccc(=O)cc3)nc(Cl)nc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 2/20 0.40
CCNB1 P14635 2/20 0.40
CCNE1 P24864 2/20 0.40
CDK2 P24941 2/20 0.40
YTHDC1 Q96MU7 10/20 0.39
SRC P12931 2/20 0.39
CNR2 P34972 1/20 0.38
P2RX7 Q99572 1/20 0.37
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
PI4KA P42356 1/20 0.35
PI4K2B Q8TCG2 1/20 0.35
PI4K2A Q9BTU6 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
PDE8A O60658 1/20 0.35
P2RY1 P47900 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL17364304 0.84 CDK1 (0.57) CDK1CCNB1CCNE1CDK2SRC
SCHEMBL17364295 0.81 CDK1 (0.40) CDK1CCNB1CCNE1CDK2YTHDC1
SCHEMBL17364276 0.80 ADORA2A (0.51) CDK1CCNB1CCNE1CDK2ADORA2A
SCHEMBL17364320 0.77 YTHDC1 (0.41) CDK1CCNB1CCNE1CDK2YTHDC1
SCHEMBL183244 0.74 CDK1 (0.51) CDK1CCNB1CCNE1CDK2YTHDC1
SCHEMBL29444616 0.74 CDK1 (0.51) CDK1CCNB1CCNE1CDK2YTHDC1
SCHEMBL25229546 0.73 CDK1 (0.41) CDK1CCNB1CCNE1CDK2YTHDC1
SCHEMBL25280903 0.73 TLR7 (0.51) CDK1CCNB1CCNE1CDK2YTHDC1
SCHEMBL17367344 0.72 PNP (0.43) YTHDC1ADORA1
SCHEMBL3440998 0.71 CDK1 (0.71) CDK1CCNB1CCNE1CDK2ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 US disclosed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 US disclosed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 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-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods PNP, ATIC, NT5C3B CDK1 1071/4885CCNB1 890/4885CCNE1 2170/4885

“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.