SCHEMBL5470898

SCHEMBL5470898

COc1ccc(-c2ccc3cc(C)c4n[nH]c(=O)n4c3c2)c(CO)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 10/20 0.48
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PDE3B Q13370 1/20 0.41
PDE1C Q14123 1/20 0.41
PDE3A Q14432 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
BAZ2B Q9UIF8 1/20 0.40
BAZ2A Q9UIF9 1/20 0.40
METAP2 P50579 2/20 0.38
MAP3K7 O43318 1/20 0.38
JAK2 O60674 1/20 0.38
KDR P35968 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
CYP1A2 P05177 1/20 0.37
GSTP1 P09211 1/20 0.36
GPR55 Q9Y2T6 1/20 0.35

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
SCHEMBL5476565 0.81 CHEK1 (0.73) CHEK1
SCHEMBL5483335 0.81 KDM4E (0.44) CHEK1PDE1APDE1BPDE3BPDE1C
SCHEMBL14492324 0.77 CHEK1 (0.47) CHEK1PDE1APDE1BPDE3BPDE1C
SCHEMBL5478073 0.69 CHEK1 (0.63) CHEK1PDE1APDE1BPDE3BPDE1C
SCHEMBL14795981 0.67 METAP2 (0.65) METAP2
SCHEMBL6719010 0.67 HTR2A (0.54) CYP11B1CYP11B2BAZ2BBAZ2A
SCHEMBL5469934 0.66 CHEK1 (0.39) CHEK1MAP3K7JAK2KDR
SCHEMBL5469037 0.65 CHEK1 (0.66) CHEK1MAP3K7JAK2KDR
SCHEMBL5475725 0.65 CHEK1 (0.45) CHEK1PDE1APDE1BPDE3BPDE1C
SCHEMBL26768678 0.65 BAZ2B (0.56) CYP11B1CYP11B2BAZ2BBAZ2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 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-20070149560-A1 Novel fused triazolones and the uses thereof TP53, BRCA1, KLK3 CHEK1 13/4885PDE1A 3278/4885PDE1B 3484/4885

“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.