SCHEMBL5701692

SCHEMBL5701692

CO[Si](O[Si](C)(C)C)(O[Si](C)(C)C)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
POLB P06746 1/20 0.34
CA4 P22748 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 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
SCHEMBL9715929 0.95 ESR1 (0.35) ESR1ESR2POLBCA4KDM4E
SCHEMBL339880 0.88 ESR1 (0.39) ESR1ESR2CA4
SCHEMBL6546676 0.86 ESR1 (0.38) ESR1ESR2POLBCA4SMN1; SMN2
SCHEMBL6547559 0.86 ESR1 (0.38) ESR1ESR2POLBCA4SMN1; SMN2
SCHEMBL6547160 0.86 ESR1 (0.38) ESR1ESR2POLBCA4SMN1; SMN2
SCHEMBL18094270 0.85 ESR1 (0.32) ESR1ESR2POLBCA4
SCHEMBL18094254 0.84 ESR1 (0.31) ESR1ESR2POLB
SCHEMBL645431 0.83 POLB (0.38) ESR1ESR2POLBCA4KDM4E
SCHEMBL37986 0.83 CA4 (0.41) ESR1ESR2POLBCA4KDM4E
SCHEMBL8437442 0.83 ESR1 (0.33) ESR1ESR2POLBCA4KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1510520-B1 Preparation of branched siloxane SHINETSU CHEMICAL CO (JP) 2006-07-26 EP disclosed
US-6943264-B2 Preparation of branched siloxane SHIN-ETSU CHEMICAL, CO., LTD. (JP) 2005-09-13 US disclosed
US-20050049427-A1 Preparation of branched siloxane SHIN-ETSU CHEMICAL CO., LTD. (JP) 2005-03-03 US disclosed
EP-1510520-A1 Preparation of branched siloxane Shin-Etsu Chemical Co., Ltd. (JP) 2005-03-02 EP disclosed