SCHEMBL2264611

SCHEMBL2264611

C[Si](C)(C)CCOCn1cc(-n2ccc(=O)c(CO)n2)cn1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DGAT1 O75907 2/20 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
SCHEMBL13274675 0.90 DGAT1 (0.31) DGAT1
SCHEMBL13449247 0.89 GAA (0.33) GAAALDH1A1POLBKMT2ARAB9A
SCHEMBL13274757 0.85 CYP2C9 (0.48) GAAALDH1A1POLBKMT2AKDM4E
SCHEMBL2275780 0.84 GAA (0.52) GAAALDH1A1POLBKMT2ARAB9A
SCHEMBL13449244 0.79 CREBBP (0.31)
SCHEMBL2365515 0.78 HSD17B13 (0.34) DGAT1
SCHEMBL13275045 0.77 PARP1 (0.35)
SCHEMBL13274833 0.75 PPARG (0.33) DGAT1
SCHEMBL173996 0.75 CYP2C9 (0.37) GAAALDH1A1POLBKMT2ARAB9A
SCHEMBL13275282 0.74 LMNA (0.37) ALDH1A1KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 GAA 1463/4885ALDH1A1 1673/4885POLB 1954/4885

“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.