SCHEMBL4151382

SCHEMBL4151382

CCCCOC(=O)c1ccccc1C(=O)OO

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.86
TDP1 Q9NUW8 3/20 0.86
L3MBTL1 Q9Y468 2/20 0.86
MAPK1 P28482 4/20 0.77
CYP3A4 P08684 3/20 0.77
TP53 P04637 1/20 0.77
ALDH1A1 P00352 8/20 0.75
LMNA P02545 2/20 0.75
HSD17B10 Q99714 2/20 0.69
KDM4E B2RXH2 2/20 0.60
POLB P06746 1/20 0.60
CA2 P00918 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C19 P33261 2/20 0.52
ESR1 P03372 1/20 0.51
CYP2D6 P10635 1/20 0.51
NR1H2 P55055 1/20 0.51
RNASEL Q05823 1/20 0.51
MAPT P10636 1/20 0.51

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
SCHEMBL27670583 0.93 ALDH1A1 (0.87) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL27893036 0.93 TSHR (0.93) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL2330224 0.93 TSHR (1.00) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL29353340 0.93 TSHR (1.00) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL4596231 0.93 TSHR (1.00) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL24051 0.93 TSHR (1.00) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL23248522 0.91 TSHR (0.96) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL8813340 0.91 TSHR (0.96) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL2330218 0.91 TSHR (0.96) TSHRTDP1L3MBTL1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL11287116 0.91 TSHR (0.96) TSHRTDP1L3MBTL1MAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106526054-B A kind of method of phthalic acid ester metabolite, bisphenol-A and estrogen in quick analysis urine 复旦大学 2018-05-25 CN claimed
EP-1898886-B1 NOVEL SUSTAINED RELEASE DOSAGE FORM RUBICON RES PVT LTD (IN) 2019-09-04 EP disclosed
US-9629915-B2 Sustained release dosage form RUBICON RESEARCH PRIVATE LIMITED (IN) 2017-04-25 US disclosed
US-20150150991-A1 NOVEL SUSTAINED RELEASE DOSAGE FORM PILGAONKAR PRATIBHA S (IN) 2015-06-04 US disclosed
US-8920837-B2 Sustained release dosage form RUBICON RESEARCH PRIVATE LIMITED (IN) 2014-12-30 US disclosed
US-20090053310-A1 NOVEL SUSTAINED RELEASE DOSAGE FORM RUBICON RESEARCH PVT. LTD. 2009-02-26 US disclosed
EP-1898886-A2 NOVEL SUSTAINED RELEASE DOSAGE FORM Rubicon Research Private Limited (IN) 2008-03-19 EP disclosed
WO-2007036952-A2 NOVEL SUSTAINED RELEASE DOSAGE FORM RUBICON RESEARCH PVT LTD. (IN) 2007-04-05 WO disclosed
US-4808416-A COATED ACRYLIC COPOLYMERS AND ENTERIC CELLULOSES LABORATORIES DELAGRANGE (FR) 1989-02-28 US disclosed
US-4327175-A COUPLERS AND HIGH-BOILING SOLVENTS OF CYCLOALKYL ESTERS OF BENZENE OR ANTISOLILANTS; PREVENTION OF COLOR DEEPENING FUJI PHOTO FILM CO., LTD. (JP) 1982-04-27 US disclosed