SCHEMBL28296674

SCHEMBL28296674

CCCCOC(=O)c1ccoc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
TDP1 Q9NUW8 2/20 0.57
MAPK1 P28482 3/20 0.51
CYP3A4 P08684 3/20 0.51
TP53 P04637 1/20 0.51
ALDH1A1 P00352 6/20 0.51
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HSD17B10 Q99714 2/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
ESR1 P03372 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
NR1H2 P55055 1/20 0.46
RNASEL Q05823 1/20 0.46
CYP2C9 P11712 1/20 0.45
PDE4D Q08499 1/20 0.45

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
SCHEMBL28308703 0.94 ALDH1A1 (0.59) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28660741 0.91 ALDH1A1 (0.54) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL9863067 0.91 TSHR (0.60) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28360318 0.91 TDP1 (0.46) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28295220 0.88 TSHR (0.57) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL19990370 0.88 TSHR (0.53) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28296974 0.87 TSHR (0.55) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28296969 0.87 TSHR (0.55) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28902553 0.86 TSHR (0.61) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL28511326 0.85 ALDH1A1 (0.62) TSHRL3MBTL1TDP1MAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109810247-A Furyl copolyesters and preparation method thereof 中国科学院宁波材料技术与工程研究所 2019-05-28 CN claimed
CN-109810248-A Furandicarboxylic acid copolyesters and preparation method thereof 中国科学院宁波材料技术与工程研究所 2019-05-28 CN claimed
CN-109679300-B Thermoplastic polyester compound and preparation method and product thereof 中国科学院宁波材料技术与工程研究所 2021-11-30 CN disclosed
CN-110520460-A Process for the preparation of poly (alkylene furandicarboxylate) DU PONT 2019-11-29 CN disclosed
CN-110520459-A Process for preparing poly (trimethylene furandicarboxylate) using zinc catalyst DUPONT IND BIOSCIENCES USA LLC 2019-11-29 CN disclosed
CN-110072908-A The method for being used to prepare poly- (three methylene ester of furandicarboxylic acid) 纳幕尔杜邦公司 2019-07-30 CN disclosed
CN-109810248-A Furandicarboxylic acid copolyesters and preparation method thereof 中国科学院宁波材料技术与工程研究所 2019-05-28 CN disclosed
CN-109679300-A Thermoplastic polyester complex and preparation method thereof, product 中国科学院宁波材料技术与工程研究所 2019-04-26 CN disclosed