SCHEMBL8087340

SCHEMBL8087340

C=C(C)C(=O)OCCOCCC[Si](C)(Cl)Cl

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.54
TSHR P16473 6/20 0.45
ALDH1A1 P00352 5/20 0.37
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL1482271 0.90 THRB (0.54) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL632865 0.90 TSHR (0.55) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL6652309 0.89 THRB (0.56) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL4849126 0.89 THRB (0.56) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL15081586 0.85 THRB (0.56) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL9805448 0.85 TSHR (0.58) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL6509806 0.84 THRB (0.54) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL2367366 0.84 THRB (0.54) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL15477542 0.83 TSHR (0.61) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1023058 0.83 TSHR (0.61) THRBTSHRALDH1A1POLBAPEX1

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
EP-0639576-B1 Organopolysiloxanes having a silanol group and process of making them SHINETSU CHEMICAL CO (JP) 2000-10-11 EP disclosed
US-5508369-A ROOM TEMPERATURE CURABLE LIQUID SILICONE RUBBER SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-04-16 US disclosed
EP-0639576-A1 Organopolysiloxanes having a silanol group and process of making them Shin-Etsu Chemical Co., Ltd. (JP) 1995-02-22 EP disclosed