SCHEMBL2908497

SCHEMBL2908497

COc1nc(N)nc2n[nH]cc12

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 3/20 0.37
▸ CCNA2 P20248 10/20 0.37
▸ CDK2 P24941 10/20 0.37
▸ CCNA1 P78396 10/20 0.37
▸ CDK1 P06493 9/20 0.35
▸ CCNB1 P14635 9/20 0.35
▸ MGMT P16455 4/20 0.35
▸ MPO P05164 2/20 0.35
▸ PIN1 Q13526 2/20 0.33

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
SCHEMBL1014919 0.76 PDPK1 (0.39) —
SCHEMBL888386 0.73 MGMT (0.30) CCNA2CDK2CCNA1CDK1CCNB1
SCHEMBL5144478 0.73 ADORA2A (0.44) MGMTMPO
SCHEMBL2908498 0.69 CDK2 (0.54) PIK3CACCNA2CDK2CCNA1
SCHEMBL10562546 0.68 DHFR (0.44) PIK3CA
SCHEMBL7958023 0.66 HRH4 (0.45) —
Methylguanine SCHEMBL231097 0.66 CDK1 (0.69) CCNA2CDK2CCNA1CDK1CCNB1
Methylguanine SCHEMBL29903462 0.66 CDK1 (0.69) CCNA2CDK2CCNA1CDK1CCNB1
SCHEMBL3418434 0.66 CCNA2 (0.36) PIK3CACCNA2CDK2CCNA1CDK1
SCHEMBL16828162 0.65 CCNA2 (0.50) PIK3CACCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1975256-B1 Modified oligonucleotides for mismatch discrimination EPOCH BIOSCIENCES INC (US) 2012-07-11 — — EP disclosed
EP-1261616-B1 MODIFIED OLIGONUCLEOTIDES FOR MISMATCH DISCRIMINATION EPOCH BIOSCIENCES INC (US) 2010-08-18 — — EP disclosed
US-7751982-B2 TM leveling methods ELITECH HOLDING B.V. (NL) 2010-07-06 — — US disclosed
EP-1995330-A1 Modified oligonucleotides for mismatch discrimination Epoch Biosciences, Inc. (US) 2008-11-26 — — EP disclosed
EP-1975256-A1 Modified oligonucleotides for mismatch discrimination Epoch Biosciences, Inc. (US) 2008-10-01 — — EP disclosed
EP-1944310-A2 Modified oligonucleotides for mismatch discrimination Epoch Biosciences, Inc. (US) 2008-07-16 — — EP disclosed
EP-1427743-A4 PROCESS FOR THE SYNTHESIS OF PYRAZOLOPYRIMIDINES EPOCH BIOSCIENCES INC (US) 2007-04-04 — — EP disclosed
US-20070060744-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. (US) 2007-03-15 — — US disclosed
US-7045610-B2 Modified oligonucleotides for mismatch discrimination EPOCH BIOSCIENCES, INC. (US) 2006-05-16 — — US disclosed
US-20060014943-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. (US) 2006-01-19 — — US disclosed
US-6962991-B2 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. (US) 2005-11-08 — — US disclosed
US-20050075491-A1 TM leveling methods EPOCH BIOSCIENCES, INC. (US) 2005-04-07 — — US disclosed
US-20040191824-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. 2004-09-30 — — US disclosed
EP-1427743-A2 PROCESS FOR THE SYNTHESIS OF PYRAZOLOPYRIMIDINES Epoch Biosciences, Inc. (US) 2004-06-16 — — EP disclosed
US-6683173-B2 CONJUGATING OLIGONUCLEOTIDE WITH 3-SUBSTITUTED PYRAZOLO(3,4-D)PYRIMIDINES AND/OR 5-SUBSTITUTED PYRIMIDINE MINOR GROOVE BINDER EPOCH BIOSCIENCES, INC. 2004-01-27 — — US disclosed
US-20030235822-A1 Systems and methods for predicting oligonucleotide melting temperature (TmS) EPOCH BIOSCIENCES, INC. 2003-12-25 — — US disclosed
US-20030224359-A1 TMLEVELING METHODS EPOCH BIOSCIENCES, INC. 2003-12-04 — — US disclosed
US-20030078413-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. 2003-04-24 — — US disclosed
WO-2003022859-A2 PROCESS FOR THE SYNTHESIS OF PYRAZOLOPYRIMIDINES EPOCH BIOSCIENCES, INC. (US) 2003-03-20 — — WO 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 (5 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-20030078413-A1 Process for the synthesis of pyrazolopyrimidines DPYD, PNP, UMPS PIK3CA 926/4885CCNA2 2019/4885CDK2 553/4885
US-20050075491-A1 TM leveling methods RNGTT, TYMS, NT5C3B PIK3CA 2315/4885CCNA2 4870/4885CDK2 4077/4885
US-20060014943-A1 Process for the synthesis of pyrazolopyrimidines DPYD, PNP, UMPS PIK3CA 926/4885CCNA2 2019/4885CDK2 553/4885
US-20070060744-A1 Process for the synthesis of pyrazolopyrimidines DPYD, PNP, UMPS PIK3CA 926/4885CCNA2 2019/4885CDK2 553/4885
US-20030224359-A1 TMLEVELING METHODS PTBP3, RNGTT, DTYMK PIK3CA 3455/4885CCNA2 4763/4885CDK2 3408/4885

“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.

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