SCHEMBL1806375

SCHEMBL1806375

C=CCc1c[nH]c2ncnc(O)c12

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 2/20 0.41
TAB1 Q15750 2/20 0.41
JAK3 P52333 8/20 0.34
CHEK1 O14757 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NOTUM Q6P988 1/20 0.32
GABRA1 P14867 2/20 0.32
GABRB2 P47870 2/20 0.32
MTAP Q13126 1/20 0.32
TRPA1 O75762 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
SCHEMBL16922228 0.73 MAP3K7 (0.67) MAP3K7TAB1
SCHEMBL16922240 0.71 MAP3K7 (0.57) MAP3K7TAB1JAK3CHEK1TRPA1
SCHEMBL16922247 0.69 CDK1 (0.46) MAP3K7TAB1JAK3CHEK1TRPA1
SCHEMBL7885565 0.68 MAPK1 (0.39) MAP3K7TAB1JAK3CHEK1NOTUM
SCHEMBL7887899 0.68 CHEK1 (0.61) MAP3K7TAB1JAK3CHEK1NOTUM
SCHEMBL1804027 0.68 AKT1 (0.44) CHEK1TRPA1
SCHEMBL1828363 0.67 GABRA1 (0.31) GABRA1GABRB2
SCHEMBL2059464 0.67 CDC7 (0.35) L3MBTL1GABRA1GABRB2
SCHEMBL9254230 0.65 JAK3 (0.39) MAP3K7TAB1JAK3CHEK1NOTUM
SCHEMBL15618411 0.65 IRAK4 (0.47) MAP3K7TAB1CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101535251-B Process for preparing 5-alkyl-7h-pyrrolo[2,3-d]pyrimidine-2-ols LEXICON PHARMACEUTICALS INC 2012-08-22 CN disclosed
EP-2084130-B1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-D]PYRIMIDINE-2-OLS LEXICON PHARMACEUTICALS INC (US) 2012-06-27 EP disclosed
EP-2084130-B1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-D]PYRIMIDINE-2-OLS LEXICON PHARMACEUTICALS INC (US) 2012-06-27 EP disclosed
US-7951941-B2 Process for preparing 5-alkyl-7H-pyrrolo[2,3-d] pyrimindine-2-ols LEXICON PHARMACEUTICALS, INC. (US) 2011-05-31 US disclosed
US-7951941-B2 Process for preparing 5-alkyl-7H-pyrrolo[2,3-d] pyrimindine-2-ols LEXICON PHARMACEUTICALS, INC. (US) 2011-05-31 US disclosed
CN-101535251-A Process for preparing 5-alkyl-7h-pyrrolo[2,3-d]pyrimidine-2-ols LEXICON PHARMACEUTICALS INC (US) 2009-09-16 CN disclosed
EP-2084130-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-D]PYRIMIDINE-2-OLS Lexicon Pharmaceuticals, Inc. (US) 2009-08-05 EP disclosed
EP-2084130-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-D]PYRIMIDINE-2-OLS Lexicon Pharmaceuticals, Inc. (US) 2009-08-05 EP disclosed
WO-2008051887-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-D]PYRIMIDINE-2-OLS LEXICON PHARMACEUTICALS, INC. (US) 2008-05-02 WO disclosed
WO-2008051887-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-D]PYRIMIDINE-2-OLS LEXICON PHARMACEUTICALS, INC. (US) 2008-05-02 WO disclosed
US-20080097098-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-d] PYRIMINDINE-2-OLS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2008-04-24 US disclosed
US-20080097098-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-d] PYRIMINDINE-2-OLS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2008-04-24 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-20080097098-A1 PROCESS FOR PREPARING 5-ALKYL-7H-PYRROLO[2,3-d] PYRIMINDINE-2-OLS THPO, DHPS, DPYD MAP3K7 974/4885TAB1 4734/4885JAK3 1865/4885

“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.