SCHEMBL7251102

SCHEMBL7251102

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

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.36
GAA P10253 2/20 0.36
SI P14410 2/20 0.36
MGAM2 Q2M2H8 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 3/20 0.33
HSD17B10 Q99714 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
SCHEMBL1978172 0.92 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1
SCHEMBL7251104 0.88 ALDH1A1 (0.39) MGAMGAASIMGAM2ALDH1A1
SCHEMBL451904 0.84 MGAM (0.48) MGAMGAASIMGAM2ALDH1A1
SCHEMBL19582716 0.79 LDHA (0.40) MGAMGAASIMGAM2TSHR
SCHEMBL8750517 0.79 MGAM (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL453324 0.78 GAA (0.68) MGAMGAASIMGAM2ALDH1A1
SCHEMBL1291088 0.78
SCHEMBL9068041 0.77 TSHR (0.32) TSHR
SCHEMBL14498321 0.77 MGAM (0.31) MGAMGAASIMGAM2
SCHEMBL741428 0.76 ALDH1A1 (0.38) MGAMGAASIMGAM2ALDH1A1

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-6632958-B1 An alkene (1) is added to cyclopentenone (2) under the action of an alkyl lithium and an organic copper reagent to form an adduct, said adduct is reacted with e.g. a carboxylic anhydride (4) to obtain a prostaglandin derivative, which is MITSUBISHI PHARMA CORPORATION (JP) 2003-10-14 US disclosed
EP-1085012-A1 PROCESS FOR PRODUCING PURIFIED PROSTAGLANDIN DERIVATIVE Asahi Glass Co., Ltd. (JP) 2001-03-21 EP disclosed