Pivalate

Pivalate

SCHEMBL6905029

CC(C)(C)C(=O)O.OCCCCO

nearest known ligand 0.46

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
CAMK2A Q9UQM7 1/20 0.43
TSHR P16473 3/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP4F2 P78329 3/20 0.40
CYP4A11 Q02928 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
ARG2 P78540 1/20 0.39
PPARA Q07869 1/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.37

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
Pivalate SCHEMBL29150541 0.97 FFAR1 (0.50) GPR84FFAR1FFAR4CAMK2ATSHR
Dodecanol SCHEMBL28182053 0.87 TSHR (0.62) GPR84FFAR1FFAR4TSHRALDH1A1
Cetostearyl Alcohol SCHEMBL28645692 0.87 TSHR (0.62) GPR84FFAR1FFAR4TSHRALDH1A1
Tridecan-1-Ol SCHEMBL27738842 0.87 TSHR (0.62) GPR84FFAR1FFAR4TSHRALDH1A1
Pivalate SCHEMBL6900876 0.87 TSHR (0.47) CAMK2ATSHRALDH1A1CYP2D6CYP2C19
Pivalate SCHEMBL29138458 0.87 TSHR (0.47) CAMK2ATSHRALDH1A1CYP2D6CYP2C19
Pivalate SCHEMBL10434734 0.84 LMNA (0.40) CAMK2ATSHRALDH1A1SMN1; SMN2CYP2D6
1,4-Butanediol SCHEMBL4463482 0.82 GPR84 (0.42) GPR84FFAR1FFAR4CAMK2ATSHR
1,4-Butanediol SCHEMBL3009897 0.82 GPR84 (0.42) GPR84FFAR1FFAR4CAMK2ATSHR
1,4-Butanediol SCHEMBL37084 0.82 GPR84 (0.42) GPR84FFAR1FFAR4CAMK2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117355546-A Spherical catalyst component for olefin polymerization 格雷斯公司 2024-01-05 CN disclosed
CN-103635494-A Method for polymerizing [alpha]-olefin SUNALLOMER LTD 2014-03-12 CN disclosed
CN-102656194-A Mixed donor system for high melt flow and high activity BASF CORP 2012-09-05 CN disclosed
US-6777508-B1 HIGHLY ACTIVE AND HIGHLY STEREOSPECIFIC CATALYSTS FOR THE POLYMERIZATION OF PROPYLENE AND HIGHER OLEFINS BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2004-08-17 US disclosed
US-6194342-B1 COMPRISING REACTION PRODUCT OF ALUMINUM ALKYL COMPOUND, A SILICON COMPOUND CONTAINING ONE SI--OR OR SI--OCOR OR SI--NR2 BOND, R BEING HYDROCARBYL RADICAL, A SOLID COMPRISING AS SUPPORT A MAGNESIUM DIHALIDE AND A TITANIUM HALIDE MONTELL TECHNOLOGY COMPANY BV (NL) 2001-02-27 US disclosed
CN-1054384-C Process for the preparation of olefin polymer MITSUI CHEMICALS CO LTD (JP) 2000-07-12 CN disclosed
CN-1040988-C Thermoplastic elastomer compositions MITSUI PETROCHEMICAL IND (JP) 1998-12-02 CN disclosed
CN-1029233-C Process for polymerizing olefins and catalyst for polymerizing olefins MITSUI PETROCHEMICAL IND (JP) 1995-07-05 CN disclosed
EP-0045977-B2 Components and catalysts for the polymerization of olefins MONTEDISON SPA (IT) 1995-03-15 EP disclosed
CN-1090854-A The preparation method of olefin polymer MITSUI PETROCHEMICAL IND (JP) 1994-08-17 CN disclosed
CN-1045400-A The catalyzer that the polymerization process of alkene and polymerizing olefins are used MITSUI PETROCHEMICAL IND (JP) 1990-09-19 CN disclosed
CN-1041764-A The polymerization process of alpha-olefin MITSUI PETROCHEMICAL IND (JP) 1990-05-02 CN disclosed
CN-1036216-A Composition for thermoplastic elastomer MITSUI PETROCHEMICAL IND (JP) 1989-10-11 CN disclosed
EP-0086472-B1 CATALYST FOR THE POLYMERIZATION OF OLEFINS Montedison S.p.A. (IT) 1987-05-20 EP disclosed
EP-0045977-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montedison S.p.A. (IT) 1987-01-07 EP disclosed
US-4482410-A POLYOXYBUTYLENE GLYCOL MONOPIVALATE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1984-11-13 US disclosed
US-4473660-A COORDINATION CATALYST-CONTAINING ALKYL-ALUMINUM COMPOUND, ELECTRON DONOR, TITANIUM COMPOUND AND ESTER ON MAGNESIUM HALIDE SUPPORT MONTEDISON S.P.A. (IT) 1984-09-25 US disclosed
EP-0086472-A2 Catalyst for the polymerization of olefins Montedison S.p.A. (IT) 1983-08-24 EP disclosed
EP-0045977-A2 Components and catalysts for the polymerization of olefins Montedison S.p.A. (IT) 1982-02-17 EP disclosed