SCHEMBL3142599

SCHEMBL3142599

CC(C)(C)[Si](OCC1(CNC(=O)OCc2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HTT P42858 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CTSL P07711 3/20 0.40
CTSB P07858 3/20 0.40
CTSS P25774 3/20 0.40
CTSK P43235 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
SYK P43405 1/20 0.39

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
SCHEMBL2913515 0.83 CTSL (0.43) SMN1; SMN2LMNAMEN1KMT2AALDH1A1
SCHEMBL5724218 0.80 SMN1; SMN2 (0.60) SMN1; SMN2LMNAHTTCTSLCTSB
SCHEMBL3142592 0.77 ALDH1A1 (0.42) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL2912500 0.77 OPRL1 (0.38) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL30873034 0.76 SYK (0.47) SMN1; SMN2LMNAHTTALDH1A1CTSL
SCHEMBL29071901 0.76 SYK (0.47) SMN1; SMN2LMNAHTTALDH1A1CTSL
SCHEMBL13328636 0.76 RORC (0.39) SMN1; SMN2LMNAKMT2AHTTALDH1A1
SCHEMBL20446324 0.75 CYP3A4 (0.36) SMN1; SMN2HTT
SCHEMBL28076211 0.75 LMNA (0.47) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL22929403 0.75 MAPK1 (0.40) SMN1; SMN2LMNAKMT2AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723319-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2010-05-25 US disclosed
US-20100004440-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same CHO DONG-GYU 2010-01-07 US disclosed
US-7605147-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2009-10-20 US disclosed
US-7157448-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2007-01-02 US disclosed
US-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same CHO DONG-GYU 2006-12-28 US disclosed
US-20060052346-A1 Nucleoside phosphonate derivatives useful in the treatment of HIV infections LG LIFE SCIENCES LTD. (KR) 2006-03-09 US disclosed
US-20040063668-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2004-04-01 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 (4 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-20060052346-A1 Nucleoside phosphonate derivatives useful in the treatment of HIV infections PNP, TYMP, ENTPD5 SMN1; SMN2 3295/4885LMNA 3728/4885MEN1 3813/4885
US-20100004440-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP SMN1; SMN2 3377/4885LMNA 3013/4885MEN1 2634/4885
US-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP SMN1; SMN2 3377/4885LMNA 3013/4885MEN1 2634/4885
US-20040063668-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP SMN1; SMN2 3377/4885LMNA 3013/4885MEN1 2634/4885

“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.