SCHEMBL4763704

SCHEMBL4763704

CNc1ccc2c(O[Si](C)(C)C(C)(C)C)cccc2c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.33
EPHB2 P29323 1/20 0.33
FABP7 O15540 1/20 0.32
FABP3 P05413 1/20 0.32
FABP5 Q01469 1/20 0.32
CA12 O43570 4/20 0.31
CA1 P00915 4/20 0.31
CA9 Q16790 4/20 0.31
ALDH1A1 P00352 3/20 0.31
HSD17B10 Q99714 3/20 0.31
PGR P06401 1/20 0.31
GAA P10253 1/20 0.31
PTGS1 P23219 1/20 0.31
MAPK1 P28482 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
NCF1 P14598 1/20 0.31
KDM4E B2RXH2 2/20 0.31
SLC6A4 P31645 2/20 0.31
HRH1 P35367 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
SCHEMBL4722042 0.83 FABP7 (0.43) FABP7FABP3FABP5ALDH1A1HSD17B10
SCHEMBL13171932 0.81 CYP1A2 (0.47) EGFRCA12CA1CA9ALDH1A1
SCHEMBL4791491 0.80 CA12 (0.46) FABP7FABP3FABP5CA12CA1
SCHEMBL4724171 0.79 PLAU (0.44) CA12CA1CA9ALDH1A1HSD17B10
SCHEMBL13172038 0.79 ESR1 (0.41) ALDH1A1HSD17B10KDM4ESLC6A4HPGD
SCHEMBL17977220 0.78 ALDH1A1 (0.47) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL28882452 0.77 DRD2 (0.34) EGFRCA12CA1CA9
SCHEMBL18540824 0.77 NQO1 (0.46) EGFRFABP7FABP3FABP5CA12
SCHEMBL31444192 0.75 CA12 (0.42) CA12CA1CA9MAPK1
SCHEMBL5623527 0.75 BRAF (0.40)

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-1934228-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2008-06-25 EP disclosed
WO-2007027855-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2007-03-08 WO disclosed
US-20070049603-A1 Raf inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC. 2007-03-01 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-20070049603-A1 Raf inhibitor compounds and methods of use thereof BRAF, RAF1, ARAF EGFR 748/4885EPHB2 2113/4885FABP7 2345/4885

“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.