SCHEMBL1723587

SCHEMBL1723587

CP.O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)O)c1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.87
FYN P06241 1/20 0.87
CYP1A2 P05177 1/20 0.52
TPMT P51580 3/20 0.43
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 2/20 0.39
WDR5 P61964 1/20 0.39
IL1RN P18510 1/20 0.39
NR4A1 P22736 1/20 0.38

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
SCHEMBL31031074 0.93 LCK (1.00) LCKFYNCYP1A2TPMTALDH1A1
SCHEMBL63440 0.93 LCK (1.00) LCKFYNCYP1A2TPMTALDH1A1
SCHEMBL18192038 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
SCHEMBL10834947 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
Phosphine SCHEMBL1930715 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
SCHEMBL433794 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
Ammonia Solution, Strong SCHEMBL1725951 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
Ammonia Solution, Strong SCHEMBL7022891 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
SCHEMBL6292108 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1
SCHEMBL144358 0.91 LCK (0.95) LCKFYNCYP1A2TPMTALDH1A1

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
EP-3814562-A1 SPUN YARN COMPRISING POLYESTER STAPLE FIBRE AND FABRIC COMPRISING THE SAME DuPont Industrial Biosciences USA, LLC (US) 2021-05-05 EP disclosed
EP-2403895-A1 POLY(TRIMETHYLENE TEREPHTHALATE) PELLETS WITH REDUCED OLIGOMERS AND METHOD TO MEASURE OLIGOMER REDUCTION E. I. du Pont de Nemours and Company (US) 2012-01-11 EP disclosed
EP-2334725-A1 FLAME RETARDANT POLY(TRIMETHYLENE TEREPHTHALATE) COMPOSITION E. I. du Pont de Nemours and Company (US) 2011-06-22 EP disclosed
EP-2334726-A1 FLAME RETARDANT POLY(TRIMETHYLENE TEREPHTHALATE) COMPOSITION E. I. du Pont de Nemours and Company (US) 2011-06-22 EP disclosed
WO-2010101913-A1 POLY(TRIMETHYLENE TEREPHTHALATE) PELLETS WITH REDUCED OLIGOMERS AND METHOD TO MEASURE OLIGOMER REDUCTION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-09-10 WO disclosed
WO-2010077937-A1 REDUCTION OF WHITENING OF POLY(TRIMETHYLENE TEREPHTHALATE) PARTS BY SOLVENT EXPOSURE E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-08 WO disclosed
WO-2010045202-A1 FLAME RETARDANT POLY(TRIMETHYLENE TEREPHTHALATE) COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-04-22 WO disclosed
WO-2010045181-A1 FLAME RETARDANT POLY(TRIMETHYLENE TEREPHTHALATE) COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-04-22 WO disclosed