SCHEMBL20998612

SCHEMBL20998612

Cn1cnc2c(NN)nc(Cl)nc21

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 6/20 0.73
▸ CDK1 P06493 5/20 0.68
▸ CDK2 P24941 2/20 0.53
▸ CCNE2 O96020 1/20 0.53
▸ CCNE1 P24864 1/20 0.53
▸ PDE4A P27815 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ PDE4C Q08493 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ CCNA2 P20248 1/20 0.41
▸ CCNA1 P78396 1/20 0.41
▸ CDK5 Q00535 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ CDK5R1 Q15078 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
SCHEMBL13828289 0.85 YTHDC1 (1.00) YTHDC1CDK1CDK2CCNE2CCNE1
SCHEMBL13708308 0.81 CDK1 (0.49) YTHDC1CDK1CDK2CCNE2CCNE1
SCHEMBL129921 0.81 CDK1 (1.00) YTHDC1CDK1
SCHEMBL15756901 0.81 YTHDC1 (0.69) YTHDC1CDK1CDK2CCNE2CCNE1
SCHEMBL16131580 0.80 PDE4A (0.48) YTHDC1CDK1CDK2CCNE1PDE4A
SCHEMBL21348744 0.78 YTHDC1 (0.66) YTHDC1CDK1
SCHEMBL15756616 0.78 YTHDC1 (0.66) YTHDC1CDK1CDK2CCNE2CCNE1
SCHEMBL183230 0.77 CDK1 (0.66) YTHDC1CDK1CDK2CCNE2CCNE1
SCHEMBL183098 0.77 YTHDC1 (0.64) YTHDC1CDK1CDK2CCNE2CCNE1
SCHEMBL29426225 0.77 CDK1 (0.68) YTHDC1CDK1CDK2CCNE2CCNE1

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
EP-2265626-B1 NUCLEOTIDE ANALOGUES WITH QUATERNARY CARBON STEREOGENIC CENTERS AND METHODS OF USE LCB PHARMA INC (CA) 2019-05-15 — — EP disclosed
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