SCHEMBL4873071

SCHEMBL4873071

CCC(C)c1c(Cl)nc2c(C#N)cnn2c1NC(C)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 2/20 0.47
PDE2A O00408 2/20 0.36
KDM5A P29375 2/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM4E B2RXH2 5/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CSNK2A1 P68400 7/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
GLA P06280 1/20 0.31
MAPK1 P28482 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL14280912 0.86 CDK2 (0.49) CDK2PDE2AKDM5AKDM4CKDM4E
SCHEMBL14280908 0.83 MEN1 (0.32) CDK2KMT2A
SCHEMBL4866649 0.81
SCHEMBL13606365 0.81 GBA1 (0.40) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL4874084 0.80 GBA1 (0.39) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL14280906 0.80
SCHEMBL4875792 0.80 CDK2 (0.50) CDK2KDM5AKDM4CKDM4EALDH1A1
SCHEMBL13606364 0.79 KDM4E (0.40) CDK2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL14280903 0.77
SCHEMBL4869992 0.75 KCNN3 (0.37) PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080021045-A1 7-Amino-5-Halopyrazolopyrimidines with a Fungicidal Action BAYER CROPSCIENCE AKTIENGESELLSCHSFT (DE) 2008-01-24 US disclosed
US-20080021045-A1 7-Amino-5-Halopyrazolopyrimidines with a Fungicidal Action BAYER CROPSCIENCE AKTIENGESELLSCHSFT (DE) 2008-01-24 US disclosed
US-20080021045-A1 7-Amino-5-Halopyrazolopyrimidines with a Fungicidal Action BAYER CROPSCIENCE AKTIENGESELLSCHSFT (DE) 2008-01-24 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-20080021045-A1 7-Amino-5-Halopyrazolopyrimidines with a Fungicidal Action Q6ZSR9, CYP3A7, CYP4X1 CDK2 1782/4885PDE2A 900/4885KDM5A 951/4885

“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.