Pyrimidine

Pyrimidine

SCHEMBL1723992

C1CCCC1.c1cncnc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP2A6 P11509 1/20 0.35
CYP11B2 P19099 1/20 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
Pyrimidine SCHEMBL44064 1.00 TSHR (0.40) TSHRNAPRTTDP1CYP2A6CYP11B2
Pyrimidine SCHEMBL5662611 1.00
Pyrimidine SCHEMBL7196249 1.00 TSHR (0.40) TSHRNAPRTTDP1CYP2A6CYP11B2
Pyrimidine SCHEMBL1846 0.87
Pyrimidine SCHEMBL19437633 0.87 TSHR (0.50) TSHRNAPRTTDP1CYP2A6
Pyrimidine SCHEMBL10646 0.87 TSHR (0.50) TSHRNAPRTTDP1CYP2A6
Pyrimidine SCHEMBL9545353 0.82
Pyrimidine SCHEMBL22346941 0.82
Pyrimidine SCHEMBL21315895 0.82 TSHR (0.46) TSHRNAPRTTDP1CYP2A6
Pyrimidine SCHEMBL383109 0.82

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
US-20170129898-A1 PROCESS FOR THE PREPARATION OF TRIAZOLO[4,5-D] PYRIMIDINE CYCLOPENTANE COMPOUNDS FLAMMA SPA (IT) 2017-05-11 US disclosed
EP-3157907-A1 PROCESS FOR THE PREPARATION OF TRIAZOLO[4,5-D]PYRIMIDINE CYCLOPENTANE COMPOUNDS Flamma S.P.A. (IT) 2017-04-26 EP disclosed
WO-2015193165-A1 PROCESS FOR THE PREPARATION OF TRIAZOLO[4,5-D] PYRIMIDINE CYCLOPENTANE COMPOUNDS FLAMMA SPA (IT) 2015-12-23 WO disclosed
WO-2015193165-A1 PROCESS FOR THE PREPARATION OF TRIAZOLO[4,5-D] PYRIMIDINE CYCLOPENTANE COMPOUNDS FLAMMA SPA (IT) 2015-12-23 WO disclosed
US-20150197496-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-07-16 US disclosed
EP-2404907-B1 Pyrimidyl cyclopentanes as AKT protein kinase inhibitors ARRAY BIOPHARMA INC (US) 2015-01-14 EP disclosed
EP-2173723-B3 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2014-11-19 EP disclosed
US-20140315887-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS GENENTECH, INC. 2014-10-23 US disclosed
US-8846683-B2 Pyrimidyl cyclopentanes as Akt protein kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-09-30 US disclosed
CN-103965158-A Preparation method for intermediate used for synthesis of triazolo[4,5-d]pyrimidine cyclopentane compound SHANGHAI INST PHARM INDUSTRY 2014-08-06 CN disclosed
CN-103429576-A Novel processes for preparing triazolo[4,5-d]pyrimidine derivatives and intermediates thereof ACTAVIS GROUP PTC EHF 2013-12-04 CN disclosed
US-20130143865-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS GENENTECH, INC. (US) 2013-06-06 US disclosed
CN-103003231-A Novel method for preparing phenylcyclopropylamine derivatives and use thereof for preparing ticagrelor ACTAVIS GROUP PTC EHF 2013-03-27 CN disclosed
US-8377937-B2 Pyrimidyl cyclopentanes as AKT protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2013-02-19 US disclosed
EP-2404907-A1 Pyrimidyl cyclopentanes as AKT protein kinase inhibitors Array Biopharma, Inc. (US) 2012-01-11 EP disclosed
EP-2173723-B1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2011-08-31 EP disclosed
US-20110160221-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. 2011-06-30 US disclosed
EP-2173723-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2010-04-14 EP disclosed
WO-2009006569-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-01-08 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-20150197496-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 TSHR 4004/4885NAPRT 1279/4885TDP1 444/4885
US-20140315887-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 TSHR 4004/4885NAPRT 1279/4885TDP1 444/4885
US-20130143865-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 TSHR 4004/4885NAPRT 1279/4885TDP1 444/4885
US-20110160221-A1 PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS TK1, PIK3CA, AKT1 TSHR 4004/4885NAPRT 1279/4885TDP1 444/4885
US-20170129898-A1 PROCESS FOR THE PREPARATION OF TRIAZOLO[4,5-D] PYRIMIDINE CYCLOPENTANE COMPOUNDS TBXA2R, THPO, P2RY4 TSHR 1709/4885NAPRT 729/4885TDP1 924/4885

“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.