Sugi Predict

Sugi Predict / Compounds / SCHEMBL28427686

SCHEMBL28427686

SCHEMBL28427686

CCCCC=C[Si](C=CCCCC)(OCC)OCC

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 3/20 0.33
▸ TSHR P16473 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ LPAR2 Q9HBW0 2/20 0.32
▸ LPAR1 Q92633 1/20 0.32
▸ F7 P08709 1/20 0.32
▸ F3 P13726 1/20 0.32
▸ FAAH O00519 4/20 0.32
▸ TRPV1 Q8NER1 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
SCHEMBL28893517 0.91 FAAH (0.43) LPAR3F7F3FAAHTRPV1
SCHEMBL5412014 0.86 — —
SCHEMBL5412008 0.86 — —
SCHEMBL837425 0.82 LPAR3 (0.33) LPAR3TSHRALDH1A1LPAR2LPAR1
SCHEMBL837424 0.82 LPAR3 (0.33) LPAR3TSHRALDH1A1LPAR2LPAR1
SCHEMBL5808012 0.80 TSHR (0.33) LPAR3TSHRALDH1A1LPAR2LPAR1
SCHEMBL29911006 0.80 LPAR3 (0.32) LPAR3TSHRALDH1A1LPAR2LPAR1
SCHEMBL5808009 0.80 TSHR (0.33) LPAR3TSHRALDH1A1LPAR2LPAR1
SCHEMBL28433315 0.79 TSHR (0.35) LPAR3TSHRALDH1A1LPAR2LPAR1
SCHEMBL930237 0.78 LPAR3 (0.32) LPAR3TSHRALDH1A1LPAR2LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109912736-B External electron donor for olefin polymerization catalyst, catalyst system and preparation method of polyolefin 中国科学院化学研究所 2020-07-14 — — CN disclosed