SCHEMBL4808906

SCHEMBL4808906

Oc1ccc2c(c1)Cc1c(-c3ccc(-c4ccc(O)c(F)c4)cc3)n[nH]c1-2

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 19/20 0.77
KDR P35968 1/20 0.53
SGK1 O00141 1/20 0.50
AURKA O14965 1/20 0.50
CSNK2A2 P19784 1/20 0.50
AKT1 P31749 1/20 0.50
AKT2 P31751 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
AKT3 Q9Y243 1/20 0.50

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
SCHEMBL4818573 0.88 CHEK1 (1.00) CHEK1KDRSGK1AURKACSNK2A2
SCHEMBL4815096 0.87 CHEK1 (0.76) CHEK1KDR
SCHEMBL4811559 0.86 CHEK1 (0.77) CHEK1KDRSGK1AURKACSNK2A2
SCHEMBL4819436 0.83 CHEK1 (0.74) CHEK1KDRAURKA
SCHEMBL6212058 0.81 CHEK1 (0.79) CHEK1KDR
SCHEMBL4815953 0.79 CHEK1 (0.78) CHEK1KDRSGK1AURKACSNK2A2
SCHEMBL4809945 0.79 CHEK1 (0.78) CHEK1
SCHEMBL4814994 0.79 CHEK1 (0.77) CHEK1SGK1AURKACSNK2A2AKT1
SCHEMBL4815837 0.76 CHEK1 (1.00) CHEK1KDR
SCHEMBL4806113 0.75 CHEK1 (0.70) CHEK1KDRSGK1AURKACSNK2A2

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-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBVIE INC. 2004-12-23 US claimed
US-7320986-B2 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBOTT LABORTORIES (US) 2008-01-22 US disclosed
US-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBVIE INC. 2004-12-23 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-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors TK1, MAP3K19, MAP3K20 CHEK1 73/4885KDR 1024/4885SGK1 294/4885

“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.