SCHEMBL4814003

SCHEMBL4814003

C[Si](C)(C)CCOCn1nc(-c2ccc(F)nc2)c2c1-c1ccc(CO)cc1C2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 4/20 0.36
DGAT1 O75907 4/20 0.33
ALOX5AP P20292 3/20 0.33
FEN1 P39748 3/20 0.33
P2RX7 Q99572 1/20 0.31
F2RL1 P55085 1/20 0.31
HTR1A P08908 2/20 0.30
HTR7 P34969 2/20 0.30
GBA1 P04062 1/20 0.30
UGCG Q16739 1/20 0.30
GBA2 Q9HCG7 1/20 0.30
KDR P35968 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
SCHEMBL4815094 0.88 KDR (0.43) CHEK1KDR
SCHEMBL4813087 0.87 CHEK1 (0.42) CHEK1KDR
SCHEMBL4813208 0.80 CHEK1 (0.35) CHEK1DGAT1
SCHEMBL4818711 0.72 CHEK1 (0.39) CHEK1KDR
SCHEMBL4817945 0.71 CHEK1 (0.49) CHEK1
SCHEMBL4816587 0.71 CHEK1 (0.48) CHEK1KDR
SCHEMBL4813668 0.70 CHEK1 (0.39) CHEK1ALOX5APFEN1
SCHEMBL4811592 0.70 CHEK1 (0.36) CHEK1DGAT1ALOX5APFEN1KDR
SCHEMBL4806272 0.69 CHEK1 (0.52) CHEK1
SCHEMBL15312322 0.69 DGAT1 (0.40) CHEK1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 73/4885DGAT1 3033/4885ALOX5AP 4744/4885

“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.