SCHEMBL20394641

SCHEMBL20394641

CCCCO[Si](CC)(OCCCC)OCCCC.[SiH4]

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
TSHR P16473 4/20 0.35
CYP3A4 P08684 3/20 0.35
ALDH1A1 P00352 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
ATM Q13315 1/20 0.31
CYP2D6 P10635 1/20 0.30
LPAR2 Q9HBW0 3/20 0.30
LPAR3 Q9UBY5 3/20 0.30
THRB P10828 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
SCHEMBL150402 0.97 ADRB2 (0.41) ADRB2ADRB1ADRB3TSHRCYP3A4
Ammonia Solution, Strong SCHEMBL28429234 0.94 ADRB2 (0.39) ADRB2ADRB1ADRB3TSHRCYP3A4
Methylamine SCHEMBL2762952 0.92 ADRB2 (0.43) ADRB2ADRB1ADRB3TSHRCYP3A4
Ethylenediamine SCHEMBL11135519 0.90 ADRB2 (0.42) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL1609029 0.89 LPAR3 (0.39) TSHRCA1CA2LPAR2LPAR3
SCHEMBL4454270 0.86 LPAR3 (0.43) TSHRCA1CA2LPAR2LPAR3
SCHEMBL826100 0.86 LPAR3 (0.43) TSHRCA1CA2LPAR2LPAR3
SCHEMBL30925677 0.86 ADRB2 (0.38) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL6701056 0.85 ADRB2 (0.39) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL2913836 0.84 LMNA (0.36) ADRB2ADRB1ADRB3TSHRCYP3A4

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-3351569-B1 METHOD FOR PRODUCING MODIFIED SOLUTION-POLYMERIZED DIENE RUBBER TO BE BLENDED WITH SILICA, AND RUBBER COMPOSITION CONTAINING SAME ETIC INC (JP) 2020-11-04 EP disclosed
US-10428161-B2 Method for producing modified solution-polymerized diene rubber to be blended with silica, and rubber composition containing same ERIC Inc. (JP) 2019-10-01 US disclosed
US-20180273650-A1 METHOD FOR PRODUCING MODIFIED SOLUTION-POLYMERIZED DIENE RUBBER TO BE BLENDED WITH SILICA, AND RUBBER COMPOSITION CONTAINING SAME ETIC INC. (JP) 2018-09-27 US disclosed
EP-3351569-A1 METHOD FOR PRODUCING MODIFIED SOLUTION-POLYMERIZED DIENE RUBBER TO BE BLENDED WITH SILICA, AND RUBBER COMPOSITION CONTAINING SAME Etic Inc. (JP) 2018-07-25 EP disclosed