SCHEMBL4708491

SCHEMBL4708491

COc1cccc(-c2ccc(-c3cnc4c(C(=O)O)cnn4c3C3CCCCC3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
EGLN1 Q9GZT9 1/20 0.46
DHODH Q02127 2/20 0.45
KEAP1 Q14145 6/20 0.44
NFE2L2 Q16236 6/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
AXL P30530 1/20 0.44
FLT3 P36888 1/20 0.44
TYRO3 Q06418 1/20 0.44
MERTK Q12866 1/20 0.44
NSD2 O96028 1/20 0.43
NSD1 Q96L73 1/20 0.43
NSD3 Q9BZ95 1/20 0.43
LPAR5 Q9H1C0 1/20 0.43
HPSE Q9Y251 1/20 0.43
MAPK13 O15264 1/20 0.43
PIM1 P11309 1/20 0.43
CAMKK1 Q8N5S9 1/20 0.43
CAMKK2 Q96RR4 1/20 0.43

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
SCHEMBL14014603 0.92 HSD17B10 (0.46) HSD17B10EGLN1DHODHKEAP1NFE2L2
SCHEMBL4708884 0.89 CSNK1D (0.49) HSD17B10ALDH1A1KDM4EAXLFLT3
SCHEMBL14014496 0.89 KDM4E (0.56) HSD17B10EGLN1KEAP1NFE2L2ALDH1A1
SCHEMBL14014888 0.88 CAMKK2 (0.47) KEAP1NFE2L2ALDH1A1KDM4EAXL
SCHEMBL14014543 0.88 ALKBH1 (0.46) HSD17B10EGLN1KEAP1NFE2L2AXL
SCHEMBL14014911 0.87 CAMKK1 (0.44) EGLN1KEAP1NFE2L2ALDH1A1KDM4E
SCHEMBL4708828 0.86 CAMKK2 (0.44) DHODHKEAP1NFE2L2ALDH1A1KDM4E
SCHEMBL14014598 0.86 HSD17B10 (0.41) HSD17B10KEAP1NFE2L2ALDH1A1KDM4E
SCHEMBL14014880 0.86 KEAP1 (0.46) KEAP1NFE2L2ALDH1A1KDM4EAXL
SCHEMBL14014902 0.85 KEAP1 (0.43) KEAP1NFE2L2FLT3PIM1CAMKK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
EP-1934225-A1 PYRAZOLO [1,5-A] PYRIMIDINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2008-06-25 EP disclosed
EP-1511751-B1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS NEOGENESIS PHARMACEUTICALS INC (US) 2008-03-19 EP disclosed
WO-2007044410-A1 PYRAZOLO [1,5-A] PYRIMIDINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-04-19 WO disclosed
WO-2007044410-A1 PYRAZOLO [1,5-A] PYRIMIDINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-04-19 WO disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-20060094706-A1 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION 2006-05-04 US disclosed
EP-1511751-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS Neogenesis Pharmaceuticals, Inc. (US) 2005-03-09 EP disclosed
US-20040038993-A1 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents NEOGENESIS PHARMACEUTICALS, INC. 2004-02-26 US disclosed
WO-2003101993-A1 PYRAZOLO` 1,5A! PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS NEOGENESIS PHARMACEUTICALS, INC. (US) 2003-12-11 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 (2 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-20040038993-A1 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents RNGTT, PNP, ZC3HAV1 HSD17B10 3322/4885EGLN1 2263/4885DHODH 120/4885
US-20060094706-A1 Pyrazolopyrimidines as protein kinase inhibitors CDKN1A, EIF2AK2, DCK HSD17B10 4380/4885EGLN1 3789/4885DHODH 1211/4885

“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.