SCHEMBL25793377

SCHEMBL25793377

Cc1ccc(Oc2ccnc3c2ccn3COCC[Si](C)(C)C)cc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
HTR2A P28223 4/20 0.34
SLC6A4 P31645 4/20 0.34
MET P08581 7/20 0.33
DRD1 P21728 1/20 0.32
KCNH2 Q12809 3/20 0.32
DGAT1 O75907 2/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL25793364 0.91 MET (0.34) METDGAT1PDGFRA
SCHEMBL25251094 0.86 KDR (0.40) METPDGFRBPDGFRA
SCHEMBL17392276 0.85 MET (0.35) HTR2ASLC6A4METKCNH2DGAT1
SCHEMBL29958930 0.82 MPO (0.35) DGAT1
SCHEMBL25802342 0.81 KDR (0.37) METDGAT1PDGFRA
SCHEMBL25249487 0.81 KDR (0.43) METPDGFRA
SCHEMBL25793378 0.81 DGAT1 (0.36) HTTHTR2ASLC6A4KCNH2DGAT1
SCHEMBL25243884 0.78 MET (0.37) METDGAT1PDGFRA
SCHEMBL23762251 0.77 L3MBTL1 (0.38) METDGAT1MAPT
SCHEMBL20588913 0.77 AXL (0.33) DGAT1NPC1

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-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 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-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 HTT 1380/4885HTR2A 4344/4885SLC6A4 4394/4885

“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.