SCHEMBL2998252

SCHEMBL2998252

CC(C)(C)[Si](C)(C)OCC1c2ccccc2-c2ccc(N)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
HTR2A P28223 1/20 0.36
KMT2A Q03164 2/20 0.33
FABP5 Q01469 3/20 0.32
FABP7 O15540 2/20 0.32
NR3C1 P04150 1/20 0.32
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
NPC1 O15118 2/20 0.31
ALDH1A1 P00352 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 2/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
EPHX2 P34913 1/20 0.31
TOP2A P11388 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
SCHEMBL14062500 0.86 CA1 (0.42) CA1CA2HTR2AKMT2AFABP5
SCHEMBL12402581 0.74 HTR2A (0.47) CA1CA2HTR2AKMT2ANR3C1
SCHEMBL13826222 0.73 KMT2A (0.48) CA1CA2KMT2AFABP5FABP7
SCHEMBL14627541 0.72 KMT2A (0.42) KMT2AALDH1A1SMN1; SMN2TSHRTDP1
SCHEMBL13258633 0.71 FABP5 (0.51) CA1CA2HTR2AKMT2AFABP5
SCHEMBL29844647 0.70 HTR2A (0.47) CA1CA2HTR2AKMT2AFABP5
SCHEMBL1230997 0.70 HTR2A (0.47) CA1CA2HTR2AKMT2AFABP5
SCHEMBL28936568 0.69 KMT2A (0.41) CA1CA2KMT2AFABP5FABP7
SCHEMBL3919560 0.68 CYP1A2 (0.43) TOP2ADUT
SCHEMBL28342668 0.68 TDO2 (0.48) CA1CA2HTR2AKMT2ACDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2170821-B1 METHOD FOR PREPARING FMOC-BASED HYDROLYSABLE LINKERS Baxalta GmbH (CH) 2016-11-30 EP disclosed
US-8871949-B2 Method for preparing FMOC-based hydrolysable linkers BAXTER INTERNATIONAL INC. (US) 2014-10-28 US disclosed
US-8871949-B2 Method for preparing FMOC-based hydrolysable linkers BAXTER INTERNATIONAL INC. (US) 2014-10-28 US disclosed
US-8871949-B2 Method for preparing FMOC-based hydrolysable linkers BAXTER INTERNATIONAL INC. (US) 2014-10-28 US disclosed
EP-1628998-B1 A TAG FOR PURIFICATION OF PEPTIDES ALMAC SCIENCES SCOTLAND LTD (GB) 2011-02-23 EP disclosed
US-20100197940-A1 Method for Preparing FMOC-Based Hydrolysable Linkers BAXTER INTERNATIONAL INC. (US) 2010-08-05 US disclosed
US-20100197940-A1 Method for Preparing FMOC-Based Hydrolysable Linkers BAXTER INTERNATIONAL INC. (US) 2010-08-05 US disclosed
US-7714147-B2 reacting a 9-hydroxymethyl-2-amino fluorene with a silyl protecting reagent e.g. tert-butyldimethylsilyl chloride to form tert-butyldimethylsiloxy-9-methyl-2-aminofluorene, reacting intermediate with 3-maleimidopropionic acid; protecting; chemical intermediates for protein and peptide drugs BAXTER INTERNATIONAL INC. (US) 2010-05-11 US disclosed
US-7714147-B2 reacting a 9-hydroxymethyl-2-amino fluorene with a silyl protecting reagent e.g. tert-butyldimethylsilyl chloride to form tert-butyldimethylsiloxy-9-methyl-2-aminofluorene, reacting intermediate with 3-maleimidopropionic acid; protecting; chemical intermediates for protein and peptide drugs BAXTER INTERNATIONAL INC. (US) 2010-05-11 US disclosed
EP-2170821-A1 METHOD FOR PREPARING FMOC-BASED HYDROLYSABLE LINKERS BAXTER INTERNATIONAL INC. (US) 2010-04-07 EP disclosed
US-20090005574-A1 reacting a 9-hydroxymethyl-2-amino fluorene with a silyl protecting reagent e.g. tert-butyldimethylsilyl chloride to form tert-butyldimethylsiloxy-9-methyl-2-aminofluorene, reacting intermediate with 3-maleimidopropionic acid; protecting; chemical intermediates for protein and peptide drugs BAXTER INTERNATIONAL INC. (US) 2009-01-01 US disclosed
US-20090005574-A1 reacting a 9-hydroxymethyl-2-amino fluorene with a silyl protecting reagent e.g. tert-butyldimethylsilyl chloride to form tert-butyldimethylsiloxy-9-methyl-2-aminofluorene, reacting intermediate with 3-maleimidopropionic acid; protecting; chemical intermediates for protein and peptide drugs BAXTER INTERNATIONAL INC. (US) 2009-01-01 US disclosed
WO-2009000523-A1 METHOD FOR PREPARING FMOC-BASED HYDROLYSABLE LINKERS BAXTER INTERNATIONAL INC. (US) 2008-12-31 WO disclosed
US-20070010673-A1 Purification means CSS-ALBACHEM LIMITED (GB) 2007-01-11 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 (3 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-20100197940-A1 Method for Preparing FMOC-Based Hydrolysable Linkers DNPEP, VIP, HM13 CA1 714/4885CA2 3866/4885HTR2A 3213/4885
US-20090005574-A1 reacting a 9-hydroxymethyl-2-amino fluorene with a silyl protecting reagent e.g. tert-butyldimethylsilyl chloride to form tert-butyldimethylsiloxy-9-methyl-2-aminofluorene, reacting intermediate with 3-maleimidopropionic acid; protecting; chemical intermediates for protein and peptide drugs HGFAC, PTMS, PRMT9 CA1 1896/4885CA2 2461/4885HTR2A 2114/4885
US-20070010673-A1 Purification means ANPEP, DNPEP, VIP CA1 2145/4885CA2 4170/4885HTR2A 4464/4885

“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.