SCHEMBL28066985

SCHEMBL28066985

CCCC(OCC)OC(=O)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
POLB P06746 2/20 0.47
CNR2 P34972 3/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PAM P19021 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KLK7 P49862 5/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
AKR1B1 P15121 1/20 0.39

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
SCHEMBL28395077 0.91 TSHR (0.54) TSHRPOLBCNR2ALDH1A1MAPK1
SCHEMBL28389994 0.90 TSHR (0.53) TSHRCNR2ALDH1A1MAPK1L3MBTL1
SCHEMBL28392237 0.88 TSHR (0.60) TSHRCNR2ALDH1A1MAPK1L3MBTL1
SCHEMBL28393423 0.87 TSHR (0.53) TSHRPOLBCNR2ALDH1A1MAPK1
SCHEMBL28066986 0.86 TSHR (0.58) TSHRPOLBCNR2ALDH1A1MAPK1
SCHEMBL28389287 0.81 TSHR (0.53) TSHRCNR2ALDH1A1MAPK1L3MBTL1
SCHEMBL22293378 0.80 TSHR (0.62) TSHRPOLBCNR2ALDH1A1MAPK1
SCHEMBL28389293 0.80 TSHR (0.67) TSHRPOLBCNR2ALDH1A1MAPK1
SCHEMBL10580667 0.78 TSHR (0.60) TSHRPOLBCNR2ALDH1A1MAPK1
SCHEMBL28392029 0.78 LMNA (0.49) TSHRPOLBALDH1A1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778442-A Olefin polymerization catalyst solid component, preparation method thereof, olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-11 CN claimed
CN-112759683-A Olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-07 CN claimed
CN-116135892-B Method for preparing bimodal polyethylene resin for pipe material and bimodal polyethylene resin thereof 中国石油化工股份有限公司 2024-10-15 CN disclosed
CN-111057169-B Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2023-02-28 CN disclosed
CN-111057168-B Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2022-07-12 CN disclosed
CN-111057168-A Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 CN disclosed
CN-103772536-B A kind of catalytic component for vinyl polymerization or combined polymerization and catalyst thereof SINOPEC CORP. (CN) 2016-05-25 CN disclosed