SCHEMBL276131

SCHEMBL276131

C[Si](C)(CCCNC(=O)CBr)O[Si](C)(C)CCCNC(=O)CBr

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC3 O15379 2/20 0.37
HDAC4 P56524 2/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC7 Q8WUI4 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC10 Q969S8 2/20 0.37
HDAC11 Q96DB2 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC9 Q9UKV0 2/20 0.37
HDAC5 Q9UQL6 2/20 0.37
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
FAAH O00519 2/20 0.34
ADORA1 P30542 2/20 0.33
CASP2 P42575 1/20 0.33
MTNR1A P48039 1/20 0.33

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
SCHEMBL4885721 0.85 MEN1 (0.41) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL275563 0.82 ALDH1A1 (0.56) MEN1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL13612101 0.81 MEN1 (0.36) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL18227261 0.78 KDM4E (0.56) TSHRALDH1A1SMN1; SMN2MTNR1AKDM4E
SCHEMBL6289357 0.77 TSHR (0.40) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL7114821 0.77 MEN1 (0.43) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL4879743 0.77 MEN1 (0.39) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL12660498 0.77 MEN1 (0.53) MEN1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL16853223 0.76 ALDH1A1 (0.48) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL16853220 0.76 ALDH1A1 (0.55) MEN1KMT2AHDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133512-B2 Drug delivery systems based on catonic siloxanyl macromonomers BAUSCH & LOMB INCORPORATED (US) 2012-03-13 US disclosed
US-8133511-B2 Drug delivery system based on cationic siloxanyl macromonomers BAUSCH & LOMB INCORPORATED (US) 2012-03-13 US disclosed
US-7759408-B2 Silicon-containing monomers end-capped with polymerizable cationic hydrophilic groups BAUSCH & LOMB INCORPORATED (US) 2010-07-20 US disclosed
US-20090274745-A1 Drug delivery systems based on catonic siloxanyl macromonomers BAUSCH & LOMB INCORPORATED (US) 2009-11-05 US disclosed
US-20090274744-A1 Drug delivery system based on cationic siloxanyl macromonomers BAUSCH & LOMB INCORPORATED (US) 2009-11-05 US disclosed
US-7579021-B2 Drug delivery systems based on degradable cationic siloxanyl macromonomers BAUSCH & LOMB INCORPORATED (US) 2009-08-25 US disclosed
US-20080152540-A1 PACKAGING SOLUTIONS BAUSCH & LOMB INCORPORATED (US) 2008-06-26 US disclosed
US-20080075780-A1 Drug delivery systems based on degradible cationic siloxanyl macromonomers SANTARUS, INC. 2008-03-27 US disclosed
US-20070142584-A1 Silicon-containing monomers end-capped with polymerizable cationic hydrophilic groups LABORATOIRE CHAUVIN S.A.S. (FR) 2007-06-21 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 (5 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-20080152540-A1 PACKAGING SOLUTIONS AQP1, ARGLU1, CRYZ MEN1 2673/4885KMT2A 3462/4885HDAC3 2840/4885
US-20070142584-A1 Silicon-containing monomers end-capped with polymerizable cationic hydrophilic groups STIM1, ORAI1, ORAI3 MEN1 440/4885KMT2A 3617/4885HDAC3 1780/4885
US-20090274744-A1 Drug delivery system based on cationic siloxanyl macromonomers MSR1, LPXN, SRRM2 MEN1 659/4885KMT2A 3150/4885HDAC3 1369/4885
US-20090274745-A1 Drug delivery systems based on catonic siloxanyl macromonomers MMP13, LPXN, SLC13A2 MEN1 2150/4885KMT2A 3764/4885HDAC3 1903/4885
US-20080075780-A1 Drug delivery systems based on degradible cationic siloxanyl macromonomers MSR1, LPXN, SRRM2 MEN1 700/4885KMT2A 3351/4885HDAC3 997/4885

“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.