SCHEMBL4185591

SCHEMBL4185591

COc1ccc(N2C(=O)[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H]2C2CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.44
ALDH1A1 P00352 8/20 0.40
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
GFER P55789 1/20 0.38
CCR1 P32246 1/20 0.37
CCR2 P41597 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 1/20 0.36
P2RX3 P56373 1/20 0.36

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
SCHEMBL4179389 0.81 HSD11B1 (0.39) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4179397 0.81 HSD11B1 (0.39) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4179392 0.81 HSD11B1 (0.39) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4185422 0.80 HSD11B1 (0.38) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4184940 0.80 NPSR1 (0.39) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4181612 0.79 HSD11B1 (0.36) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL5963959 0.79 HSD11B1 (0.39) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4175723 0.78 NPBWR1 (0.37) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL4175719 0.78 NPBWR1 (0.37) HSD11B1ALDH1A1LMNAMAPTGFER
SCHEMBL5964510 0.77 MMP1 (0.39) ALDH1A1CCR1CCR2KDM4ETSHR

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 HSD11B1 1690/4885ALDH1A1 664/4885LMNA 2174/4885

“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.