SCHEMBL4180191

SCHEMBL4180191

CC(C)OC(=O)N1C(=O)C(O[Si](C(C)C)(C(C)C)C(C)C)C1c1ccccc1F

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 4/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
P2RX4 Q99571 1/20 0.32
BCHE P06276 1/20 0.32
KDM4E B2RXH2 2/20 0.32
PKM P14618 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ELANE P08246 1/20 0.32
KCNN4 O15554 1/20 0.31
MAPK1 P28482 1/20 0.31
ACHE P22303 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL4180187 1.00 SCN9A (0.33) SCN9ASCN10APOLBTSHRALDH1A1
SCHEMBL4180200 1.00 SCN9A (0.33) SCN9ASCN10APOLBTSHRALDH1A1
SCHEMBL4188973 0.87 SCN9A (0.37) SCN9APOLBTSHRALDH1A1GAA
SCHEMBL4188969 0.87 SCN9A (0.37) SCN9APOLBTSHRALDH1A1GAA
SCHEMBL4188966 0.87 SCN9A (0.37) SCN9APOLBTSHRALDH1A1GAA
SCHEMBL4174183 0.84 GRM5 (0.34) SCN9ASCN10AALDH1A1
SCHEMBL4185494 0.74 CYP2D6 (0.30) CYP2D6
SCHEMBL13778884 0.73
SCHEMBL4182151 0.73
SCHEMBL7779914 0.72 ELANE (0.52) KDM4EELANE

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 2 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
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 SCN9A 486/4885SCN10A 3049/4885POLB 2983/4885

“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.