SCHEMBL5089394

SCHEMBL5089394

CC[Si](CC)(CC)O[C@@H](C(=O)O)[C@@H](NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
HPGD P15428 2/20 0.51
ALDH1A1 P00352 7/20 0.47
HDAC1 Q13547 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.42
CYP1A2 P05177 3/20 0.41
CYP3A4 P08684 3/20 0.41
TSHR P16473 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CTRB1 P17538 3/20 0.41
PRSS1 P07477 2/20 0.41
CTSG P08311 2/20 0.41
CMA1 P23946 2/20 0.41
CNR2 P34972 1/20 0.41
GPR139 Q6DWJ6 1/20 0.40

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
SCHEMBL14032267 1.00 LMNA (0.51) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL14370539 1.00 LMNA (0.51) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL8563008 0.81 CTSK (0.46)
SCHEMBL4185708 0.81 LMNA (0.50) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL13621588 0.80 LMNA (0.59) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL13048136 0.80 LMNA (0.59) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL5089400 0.78 LMNA (0.50) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL14574458 0.78 LMNA (0.56) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL14420891 0.77 LMNA (0.59) LMNAHPGDALDH1A1HDAC1SMN1; SMN2
SCHEMBL13426750 0.77 LMNA (0.59) LMNAHPGDALDH1A1HDAC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7432383-B2 Intermediates for the hemisynthesis of taxanes and preparation processes therefor SOCIETE D'ETUDE ET DE RECHERCHE EN INGENIERIE PHARMACEUTIQUE-SERIPHARM (FR) 2008-10-07 US disclosed
US-7279586-B2 Intermediates for the hemisynthesis of taxanes and preparation processes therefor SOCIETE D'ETUDE ET DE RECHERCHE EN INGENIERIE PHARMACEUTIQUE SERIPHARM (FR) 2007-10-09 US disclosed
US-20070208185-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor CHANTELOUP LUC 2007-09-06 US disclosed
US-7220871-B2 Intermediates for the hemisynthesis of taxanes and preparation processes therefor SOCIETE D'ETUDE ET DE RECHERCHE EN INGENIERIE PHARMACEUTIQUE SERIPHARM (FR) 2007-05-22 US disclosed
US-20050222089-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor CHANTELOUP LUC 2005-10-06 US disclosed
US-6825365-B2 FORMED AS ENANTIOMERS OF CIS-BETA-PHENYLGLYCIDIC ACID/BETA-PHENYLISOSERINE REACT WITH NITRILE COMPOUND VIA RITTER REACTION NOVASEP (FR) 2004-11-30 US disclosed
US-20040220256-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor CHANTELOUP LUC (FR) 2004-11-04 US disclosed
US-20020068833-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor SOCIETE D'ETUDE ET DE RECHERCHE EN INGENIERIE PHARMACEUTIQUE SERIPHARM 2002-06-06 US disclosed
EP-0863887-B1 INTERMEDIARY COMPOUNDS FOR THE HEMISYNTHESIS OF TAXANES AND PREPARATION PROCESSES THEREFOR SERIPHARM (FR) 2002-01-23 EP disclosed
US-6265587-B1 REACTING ARYLGLYCIDATE WITH A NITRILE TO OBTAIN B-ARYLISOSERINE DERIVATIVE AND TREATING PRODUCT WITH LEWIS ACID TO OBTAIN OXAZOLINE COMPOUND SOCIETE D'ETUDE ET DE RECHERCHE EN INGENIERIE PHARMACEUTIQUE SERIPHARM (FR) 2001-07-24 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-20020068833-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor DHPS, DOHH, HADH LMNA 1897/4885HPGD 275/4885ALDH1A1 561/4885
US-20070208185-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor DHPS, HASPIN, BDNF LMNA 708/4885HPGD 371/4885ALDH1A1 718/4885
US-20050222089-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor DHPS, HASPIN, BDNF LMNA 708/4885HPGD 371/4885ALDH1A1 718/4885
US-20040220256-A1 Intermediates for the hemisynthesis of taxanes and preparation processes therefor DHPS, HASPIN, BDNF LMNA 708/4885HPGD 371/4885ALDH1A1 718/4885

“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.