SCHEMBL21348832

SCHEMBL21348832

C[Si](C)(C)CCOCn1cc(I)c2cc(Cl)ncc21

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.35
EGFR P00533 1/20 0.32
IGF1R P08069 1/20 0.32
SRC P12931 1/20 0.32
FLT4 P35916 1/20 0.32
KDR P35968 1/20 0.32
FLT3 P36888 1/20 0.32
EPHB4 P54760 1/20 0.32
TEK Q02763 1/20 0.32
PTPN1 P18031 1/20 0.31
NPC1 O15118 1/20 0.30
MAPT P10636 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
SCHEMBL29546323 0.90 DGAT1 (0.35) DGAT1EGFRIGF1RSRCFLT4
SCHEMBL24377665 0.90 DGAT1 (0.35) DGAT1EGFRIGF1RSRCFLT4
SCHEMBL31748468 0.79 DGAT1 (0.35) DGAT1EGFRIGF1RSRCFLT4
SCHEMBL17919409 0.78 NPC1 (0.32) DGAT1NPC1MAPT
SCHEMBL24377812 0.78 DGAT1 (0.40) DGAT1EGFRIGF1RSRCFLT4
SCHEMBL29546470 0.78 DGAT1 (0.40) DGAT1EGFRIGF1RSRCFLT4
SCHEMBL19249996 0.78 DGAT1 (0.35) DGAT1NPC1MAPT
SCHEMBL31376396 0.75 BRD4 (0.36) DGAT1NPC1
SCHEMBL15749768 0.75 BRD4 (0.36) DGAT1NPC1
SCHEMBL31512681 0.75 DGAT1 (0.38) DGAT1MAPT

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-20190276450-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING ABBVIE INC. 2019-09-12 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-20190276450-A1 INHIBITORS OF TYROSINE KINASE 2 MEDIATED SIGNALING PTK2B, ABL1, BTK DGAT1 4822/4885EGFR 51/4885IGF1R 210/4885

“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.