SCHEMBL4179356

SCHEMBL4179356

CC(C)OC(=O)N1C(=O)[C@](C)(O[Si](C)(C)C(C)(C)C)[C@@H]1c1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.39
HSD11B1 P28845 1/20 0.38
RIPK1 Q13546 1/20 0.33
KDM4E B2RXH2 3/20 0.32
HSD17B10 Q99714 2/20 0.32
P2RX4 Q99571 1/20 0.32
ELANE P08246 1/20 0.32
LMNA P02545 1/20 0.32
CASP1 P29466 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TNKS O95271 3/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 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
SCHEMBL4183056 0.74
SCHEMBL4185358 0.74
SCHEMBL4185572 0.74
SCHEMBL4185630 0.69 ALDH1A1 (0.40) HSD11B1KDM4EHSD17B10CASP1ALDH1A1
SCHEMBL8226917 0.62 GPR119 (0.47) OPRK1
SCHEMBL4168294 0.61 HSD11B1 (0.54) HSD11B1TNKSMEN1KMT2A
SCHEMBL8221320 0.60 GPR119 (0.50) OPRK1
SCHEMBL28938508 0.59 HSD11B1 (0.40) OPRK1HSD11B1RIPK1KDM4EHSD17B10
SCHEMBL10939964 0.59 KDM4E (0.41) OPRK1RIPK1KDM4EHSD17B10LMNA
SCHEMBL30731163 0.58 KMT2A (0.58) KDM4ELMNAALDH1A1MEN1KMT2A

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 OPRK1 797/4885HSD11B1 1690/4885RIPK1 4501/4885

“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.