SCHEMBL30101425

SCHEMBL30101425

C[Si](C)(C)CCOCn1nccc(C#N)c1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
F2RL1 P55085 1/20 0.32
NPBWR1 P48145 1/20 0.32
DGAT1 O75907 1/20 0.32
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 2/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EGFR P00533 1/20 0.31
IGF1R P08069 1/20 0.31
SRC P12931 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
FLT3 P36888 1/20 0.31
EPHB4 P54760 1/20 0.31
TEK Q02763 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
SCHEMBL25108475 0.80 F2RL1 (0.32) NPC1F2RL1DGAT1
SCHEMBL31171663 0.78 NPC1 (0.36) NPC1F2RL1DGAT1ALDH1A1HPGD
SCHEMBL26136082 0.78 F2RL1 (0.40) NPC1F2RL1DGAT1EGFRIGF1R
SCHEMBL26126773 0.75 DGAT1 (0.38) NPC1F2RL1NPBWR1DGAT1ALDH1A1
SCHEMBL31171650 0.75 NPC1 (0.39) NPC1F2RL1DGAT1KDM4EALDH1A1
SCHEMBL3957728 0.74 NPC1 (0.37) NPC1F2RL1DGAT1EGFRIGF1R
SCHEMBL2028049 0.73 PKM (0.45) NPC1KDM4EALDH1A1HPGDMEN1
SCHEMBL30971585 0.73 DGAT1 (0.34) F2RL1DGAT1
SCHEMBL21521058 0.71 HTT (0.49) NPC1ALDH1A1GAAHPGDMEN1
SCHEMBL19332634 0.71 KDM4E (0.42) NPC1F2RL1DGAT1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11566020-B1 Pyridazinones as PARP7 inhibitors RIBON THERAPEUTICS, INC. (US) 2023-01-31 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-11566020-B1 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 NPC1 4551/4885F2RL1 534/4885NPBWR1 4538/4885

“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.