SCHEMBL6213992

SCHEMBL6213992

COc1cc2c(cc1OC1CCOC1)C(C)(C)c1c(-c3ccc(C#N)nc3)n[nH]c1-2

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 20/20 0.56
AURKA O14965 1/20 0.46
JAK2 O60674 1/20 0.46
CHEK2 O96017 1/20 0.46
CSF1R P07333 1/20 0.46
RPS6KB1 P23443 1/20 0.46
MARK3 P27448 1/20 0.46
FLT3 P36888 1/20 0.46
RPS6KA3 P51812 1/20 0.46
AURKB Q96GD4 1/20 0.46

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
SCHEMBL6213826 0.87 CHEK1 (0.64) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL6789026 0.84 CHEK1 (0.79) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL4806341 0.80 CHEK1 (0.57) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL6217279 0.79 CHEK1 (0.68) CHEK1RPS6KB1MARK3FLT3RPS6KA3
SCHEMBL6783178 0.77 CHEK1 (0.70) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL6218491 0.77 CHEK1 (0.55) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL6218486 0.77 CHEK1 (0.55) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL6783292 0.76 CHEK1 (0.58) CHEK1AURKACHEK2CSF1RMARK3
SCHEMBL4816804 0.76 CHEK1 (0.58) CHEK1AURKAJAK2CHEK2CSF1R
SCHEMBL6218484 0.73 CHEK1 (0.72) CHEK1AURKAJAK2CHEK2CSF1R

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
EP-1603885-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2005-12-14 EP claimed
US-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBVIE INC. 2004-12-23 US claimed
WO-2004080973-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-09-23 WO claimed

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 73/4885AURKA 314/4885JAK2 386/4885

“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.