SCHEMBL28045160

SCHEMBL28045160

CO[Si](Cc1ccccc1)(OC)OCCBr

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 2/20 0.35
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LTA4H P09960 1/20 0.32
TP53 P04637 1/20 0.31
ATM Q13315 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
DRD2 P14416 1/20 0.30
DRD1 P21728 1/20 0.30
DRD3 P35462 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
SCHEMBL28045036 0.85 TSHR (0.38) TDP1TSHRTRPA1ALDH1A1LTA4H
SCHEMBL8841125 0.84 TDP1 (0.36) TDP1TSHRTRPA1ALDH1A1LTA4H
SCHEMBL2808324 0.84 TAAR1 (0.39) TDP1TSHRALDH1A1LTA4HATM
SCHEMBL28045147 0.82 LTA4H (0.32) TSHRLTA4HTP53ATMTAAR1
SCHEMBL28045056 0.82 ALDH1A1 (0.39) TSHRALDH1A1LTA4HTP53ATM
SCHEMBL20994307 0.82 IDO1 (0.35) TSHRALDH1A1LTA4HTP53ATM
SCHEMBL28472798 0.81 LTA4H (0.41) TDP1TSHRALDH1A1LTA4H
SCHEMBL104953 0.80 TP53 (0.42) TDP1TSHRTRPA1ALDH1A1LTA4H
SCHEMBL19809353 0.80 TP53 (0.37) ALDH1A1LTA4HTP53ATMTAAR1
SCHEMBL28534659 0.79 LTA4H (0.35) TSHRALDH1A1LTA4HTP53ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105163853-B The manufacturing method of cyclic carbonate catalyst for synthesizing 丸善石油化学株式会社 2018-06-12 CN disclosed
CN-105121013-B The manufacture method of cyclic carbonate catalyst for synthesizing 丸善石油化学株式会社 2017-10-20 CN disclosed
CN-105163853-A Method for manufacturing catalyst for synthesizing cyclic carbonate MARUZEN PETROCHEM CO LTD 2015-12-16 CN disclosed
CN-105163854-A Method for producing catalyst for synthesizing cyclic carbonate NAT INST OF ADVANCED IND SCIEN 2015-12-16 CN disclosed
CN-105121013-A Method for producing catalyst for cyclic carbonate synthesis MARUZEN PETROCHEM CO LTD 2015-12-02 CN disclosed