SCHEMBL29062174

SCHEMBL29062174

C[Si](C)(C)CCOCn1ncc(-c2ccc(Br)cc2)c1-c1cn[nH]c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.36
KDR P35968 3/20 0.32
PRKAB1 Q9Y478 3/20 0.32
BMPR1B O00238 2/20 0.32
BMPR1A P36894 2/20 0.32
ACVRL1 P37023 2/20 0.32
TGFBR2 P37173 2/20 0.32
ACVR1 Q04771 2/20 0.32
BMPR2 Q13873 2/20 0.32
CLK2 P49760 5/20 0.31
HIPK1 Q86Z02 5/20 0.31
HIPK2 Q9H2X6 5/20 0.31
CLK4 Q9HAZ1 5/20 0.31
HIPK3 Q9H422 4/20 0.31
CLK1 P49759 3/20 0.31
ACVR1B P36896 1/20 0.31
TGFBR1 P36897 1/20 0.31
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
DYRK2 Q92630 2/20 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
SCHEMBL1330672 0.73 DGAT1 (0.38) DGAT1ROCK2
SCHEMBL5248323 0.71 MAPT (0.41) KDR
SCHEMBL29300737 0.71 DGAT1 (0.41) DGAT1
SCHEMBL4810703 0.70 DGAT1 (0.42) DGAT1KDR
SCHEMBL26102188 0.69 DGAT1 (0.43) DGAT1
SCHEMBL15401348 0.69 PIM1 (0.39) DGAT1CLK2HIPK1HIPK2CLK4
SCHEMBL3513153 0.69 CYP19A1 (0.41) DGAT1
SCHEMBL1440942 0.69 DGAT1 (0.40) DGAT1
SCHEMBL30385717 0.68 KMO (0.48) DGAT1
SCHEMBL2318217 0.68 KMO (0.48) 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-20250066350-A1 AROMATIC HETEROCYCLE-SUBSTITUTED COMPOUNDS, AND PREPARATION METHOD THEREFOR AND USE THEREOF INNOVSTONE THERAPEUTICS LIMITED (CN) 2025-02-27 US disclosed
CN-116262749-A Aromatic heterocycle substituted compound and preparation method and application thereof 上海翊石医药科技有限公司 2023-06-16 CN 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-20250066350-A1 AROMATIC HETEROCYCLE-SUBSTITUTED COMPOUNDS, AND PREPARATION METHOD THEREFOR AND USE THEREOF ATR, WEE1, WEE2 DGAT1 4049/4885KDR 2111/4885PRKAB1 1340/4885

“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.