SCHEMBL4168099

SCHEMBL4168099

CC(C)[Si](O[C@H]1C(=O)N(C(=O)c2ccccc2)[C@H]1C1CC1)(C(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
KMT2A Q03164 2/20 0.38
ACHE P22303 1/20 0.36
ELANE P08246 2/20 0.34
PIK3CD O00329 1/20 0.34
F2 P00734 1/20 0.34
PLAU P00749 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 1/20 0.33
FOLH1 Q04609 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 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
SCHEMBL6603366 0.83 FOLH1 (0.38) ALDH1A1KMT2AACHEMEN1POLB
SCHEMBL6603378 0.83 FOLH1 (0.38) ALDH1A1KMT2AACHEMEN1POLB
SCHEMBL6603374 0.83 FOLH1 (0.38) ALDH1A1KMT2AACHEMEN1POLB
SCHEMBL8746478 0.80 ELANE (0.49) ALDH1A1KMT2AELANEPIK3CDF2
SCHEMBL7776782 0.80 ELANE (0.49) ALDH1A1KMT2AELANEPIK3CDF2
SCHEMBL6602156 0.79 ALDH1A1 (0.38) ALDH1A1KMT2AACHEMEN1POLB
SCHEMBL6602158 0.79 ALDH1A1 (0.38) ALDH1A1KMT2AACHEMEN1POLB
SCHEMBL6602155 0.79 ALDH1A1 (0.38) ALDH1A1KMT2AACHEMEN1POLB
SCHEMBL6601552 0.78 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1POLBLMNA
SCHEMBL6601561 0.78 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1POLBLMNA

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
US-20090186868-A1 Taxane Compound Having Azetidine Ring Structure DAIICHI SANKYO COMPANY LIMITED (JP) 2009-07-23 US disclosed
US-20090186868-A1 Taxane Compound Having Azetidine Ring Structure DAIICHI SANKYO COMPANY LIMITED (JP) 2009-07-23 US disclosed
EP-1942109-A1 TAXANE COMPOUND WITH AZETIDINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2008-07-09 EP 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-20090186868-A1 Taxane Compound Having Azetidine Ring Structure ABCC1, AZI2, TPD52L2 ALDH1A1 664/4885KMT2A 950/4885ACHE 4523/4885

“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.