SCHEMBL10486641

SCHEMBL10486641

CCCCOC(=O)C(C)Oc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
ESR1 P03372 3/20 0.57
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57
MAPK1 P28482 1/20 0.57
CYP2C19 P33261 1/20 0.57
NR1H2 P55055 1/20 0.57
RNASEL Q05823 1/20 0.57
L3MBTL1 Q9Y468 3/20 0.50
LTA4H P09960 2/20 0.49
NR5A1 Q13285 1/20 0.49
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 1/20 0.45
MAPT P10636 1/20 0.44
ALDH2 P05091 1/20 0.44
TDP1 Q9NUW8 3/20 0.44
CHRM1 P11229 1/20 0.44
SLC6A2 P23975 1/20 0.44

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
SCHEMBL28292308 1.00 TSHR (0.57) TSHRESR1LMNASMN1; SMN2CYP1A2
SCHEMBL11055737 0.97 NR5A1 (0.54) TSHRESR1LMNASMN1; SMN2CYP1A2
SCHEMBL10387518 0.92 TSHR (0.53) TSHRESR1LMNASMN1; SMN2CYP1A2
SCHEMBL16672556 0.87 L3MBTL1 (0.57) TSHRLMNACYP1A2MAPK1CYP2C19
SCHEMBL1245750 0.87 TAS1R3 (0.54) TSHRLMNAL3MBTL1ALDH1A1KMT2A
SCHEMBL14544945 0.86 LMNA (0.57) TSHRESR1LMNASMN1; SMN2CYP1A2
SCHEMBL21381329 0.86 EPHX2 (0.52) LMNACYP1A2CYP2C19L3MBTL1ALDH1A1
SCHEMBL22207223 0.85 ALDH1A1 (0.46) TSHRESR1LMNASMN1; SMN2CYP1A2
SCHEMBL9621303 0.85 LMNA (0.66) TSHRESR1LMNASMN1; SMN2CYP1A2
SCHEMBL5789381 0.85 LMNA (0.66) TSHRESR1LMNASMN1; SMN2CYP1A2

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109867601-B Preparation method of (R) -2- (4-hydroxyphenoxy) butyl propionate 湖南速博生物技术有限公司 2021-05-28 CN claimed
CN-109867601-A The preparation method of one kind (R) -2- (4- hydroxyphenoxy) butyl propionate 湖南速博生物技术有限公司 2019-06-11 CN claimed
CN-109651140-A A kind of synthetic method of cyhalofop-butyl active compound 江苏中旗科技股份有限公司 2019-04-19 CN claimed
CN-102775307-A Preparation method of 2-(4-hydroxy phenoxy) butyl propionate PEI ZHOU 2012-11-14 CN claimed
CN-1184189-C Process for synthesizing 2-(4-hydroxylphenoxyl) butyl propionate DALIAN CHEMICAL PHYSICS INST (CN) 2005-01-12 CN claimed
CN-1340497-A Process for synthesizing 2-(4-hydroxylphenoxyl) butyl propionate DALIAN CHEMICAL PHYSICS INST (CN) 2002-03-20 CN claimed
CN-115490617-B Preparation process of cyhalofop-butyl with low cost and high optical purity content 江苏丰山生化科技有限公司 2024-03-26 CN disclosed
CN-115490617-A Preparation process of low-cost high-light pure content cyhalofop-butyl 江苏丰山集团股份有限公司 2022-12-20 CN disclosed
CN-109867601-B Preparation method of (R) -2- (4-hydroxyphenoxy) butyl propionate 湖南速博生物技术有限公司 2021-05-28 CN disclosed
CN-109867601-B Preparation method of (R) -2- (4-hydroxyphenoxy) butyl propionate 湖南速博生物技术有限公司 2021-05-28 CN disclosed
CN-109867601-B Preparation method of (R) -2- (4-hydroxyphenoxy) butyl propionate 湖南速博生物技术有限公司 2021-05-28 CN disclosed
CN-109938029-A A kind of fragrant phenoxy phenoxy propionic acid Herbicidal combinations of brassinolide-containing class compound 江西鑫邦科技有限责任公司 2019-06-28 CN disclosed
CN-109867601-A The preparation method of one kind (R) -2- (4- hydroxyphenoxy) butyl propionate 湖南速博生物技术有限公司 2019-06-11 CN disclosed
EP-0129034-A1 process for producing 2-(4-hydroxyphenoxy) propionate derivatives NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1984-12-27 EP disclosed
US-4489207-A DIHYDROXYBENZENE, 2-HALOFATTY ESTER OR ACYLOXIME BASF AKTIENGESELLSCHAFT (DE) 1984-12-18 US disclosed
EP-0082413-A1 Process for the preparation of esters of 2-(hydroxyphenoxy) carboxylic acid BASF Aktiengesellschaft (DE) 1983-06-29 EP disclosed
EP-0061459-A4 PROCESS FOR THE SYNTHESIS OF PHENOXYALKANE DERIVATIVES. ICI AUSTRALIA LTD (AU) 1982-12-27 EP disclosed
EP-0061459-A1 PROCESS FOR THE SYNTHESIS OF PHENOXYALKANE DERIVATIVES. ICI AUSTRALIA LTD (AU) 1982-10-06 EP disclosed
WO-1982000639-A1 PROCESS FOR THE SYNTHESIS OF PHENOXYALKANE DERIVATIVES WATSON K 1982-03-04 WO disclosed
US-4267336-A BY REACTING A 2-PHENOXYPYRIDINE DERIVATIVE WITH A 4-HYDROXYPHENOXYALKANECARBOXYLIC ACID DERIVATIVE ISHIHARA SANGYO KAISHA LTD. (JP) 1981-05-12 US disclosed