SCHEMBL4188973

SCHEMBL4188973

CC(C)[Si](O[C@@H]1C(=O)N(C(=O)OC(C)(C)C)[C@@H]1c1ccccc1F)(C(C)C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.37
GPR119 Q8TDV5 3/20 0.35
KLK7 P49862 2/20 0.34
KLK5 Q9Y337 1/20 0.34
GRM5 P41594 2/20 0.33
GRM1 Q13255 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PDE5A O76074 1/20 0.33
SCN5A Q14524 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 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
SCHEMBL4188969 1.00 SCN9A (0.37) SCN9AGPR119KLK7KLK5GRM5
SCHEMBL4188966 1.00 SCN9A (0.37) SCN9AGPR119KLK7KLK5GRM5
SCHEMBL4180191 0.87 SCN9A (0.33) SCN9APOLBALDH1A1GAATSHR
SCHEMBL4180187 0.87 SCN9A (0.33) SCN9APOLBALDH1A1GAATSHR
SCHEMBL4180200 0.87 SCN9A (0.33) SCN9APOLBALDH1A1GAATSHR
SCHEMBL2447629 0.84 GRM5 (0.37) SCN9AGPR119KLK7KLK5GRM5
SCHEMBL245192 0.84 GRM5 (0.37) SCN9AGPR119KLK7KLK5GRM5
SCHEMBL7772596 0.84 ELANE (0.46) GPR119KLK7KLK5
SCHEMBL4180233 0.80 GPR119 (0.36) GPR119KLK7KLK5POLB
SCHEMBL4180242 0.80 GPR119 (0.36) GPR119KLK7KLK5POLB

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 486/4885GPR119 1888/4885KLK7 3535/4885

“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.