SCHEMBL4810703

SCHEMBL4810703

C[Si](C)(C)CCOCn1ncc2c1-c1ccc(Br)cc1C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.42
HTR2C P28335 2/20 0.38
PDE4B Q07343 1/20 0.34
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
HTR2A P28223 1/20 0.31
CHEK2 O96017 1/20 0.31
ROS1 P08922 1/20 0.31
MARK3 P27448 1/20 0.31
LTK P29376 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
MINK1 Q8N4C8 1/20 0.31
AURKB Q96GD4 1/20 0.31
PBK Q96KB5 1/20 0.31
STK17A Q9UEE5 1/20 0.31
MAP4K5 Q9Y4K4 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL4812381 0.80 CYP1A2 (0.45) HTR2CTP53MEN1CYP1A2KMT2A
SCHEMBL29300737 0.75 DGAT1 (0.41) DGAT1PDE4BMEN1KMT2A
SCHEMBL4815995 0.74 DGAT1 (0.40) DGAT1METAP1
SCHEMBL2318217 0.73 KMO (0.48) DGAT1HTR2CHTR2AKMT2A
SCHEMBL1119861 0.73 DGAT1 (0.47) DGAT1HTR2CHTR2AKMT2A
SCHEMBL30385717 0.73 KMO (0.48) DGAT1HTR2CHTR2AKMT2A
SCHEMBL25897623 0.71 DGAT1 (0.32) DGAT1
SCHEMBL29062174 0.70 DGAT1 (0.36) DGAT1KDR
SCHEMBL20229622 0.70 DGAT1 (0.43) DGAT1
SCHEMBL22824667 0.69 DGAT1 (0.37) DGAT1

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 DGAT1 3033/4885HTR2C 4158/4885PDE4B 1222/4885

“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.