SCHEMBL4695906

SCHEMBL4695906

N#Cc1cnn2c(Cl)c(-c3cc(Cl)sc3Cl)c(Cl)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 2/20 0.40
CSNK2A1 P68400 7/20 0.38
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
HPGD P15428 3/20 0.36
HSD17B10 Q99714 2/20 0.36
GLA P06280 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM5A P29375 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
KDM4D Q6B0I6 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.32
CHEK1 O14757 1/20 0.31
CCNA2 P20248 1/20 0.31
CCNA1 P78396 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
SCHEMBL5230928 0.77 KDM4D (0.43) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL5321324 0.77 CDK2 (0.41) CDK2CSNK2A1KDM4EALDH1A1HPGD
SCHEMBL5321326 0.77 CDK2 (0.41) CDK2CSNK2A1KDM4EALDH1A1HPGD
SCHEMBL4691830 0.76 CSNK2A1 (0.46) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL5594559 0.74 CSNK2A1 (0.43) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL4695611 0.73 CSNK2A1 (0.41) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL5323810 0.72 KDM4E (0.44) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL18863648 0.71 CDK2 (0.45) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL5438939 0.71 CDK2 (0.48) CDK2CSNK2A1KDM4EALDH1A1LMNA
SCHEMBL4695582 0.69 CSNK2A1 (0.39) CDK2CSNK2A1KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641800-B1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2008-03-05 EP disclosed
WO-2007101859-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF FOR CONTROLLING PARASITIC FUNGI AND AGENTS CONTAINING THE LATTER BASF SE (DE) 2007-09-13 WO disclosed
US-20070037828-A1 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2007-02-15 US disclosed
US-20070037828-A1 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2007-02-15 US disclosed
US-20070037828-A1 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2007-02-15 US disclosed
EP-1641800-A1 PYRAZOLOPYRIMIDINES Bayer CropScience AG (DE) 2006-04-05 EP disclosed
WO-2005000851-A1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-01-06 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 (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-20070037828-A1 Pyrazolopyrimidines DPYD, RPLP2, Q6ZSR9 CDK2 500/4885CSNK2A1 2676/4885KDM4E 3205/4885

“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.