SCHEMBL3902879

SCHEMBL3902879

CCCC[PH](CCCC)(CCCC)CCCC.O=C(OCCO)c1cc(C(=O)OCCO)cc(S(=O)(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.43
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
STS P08842 4/20 0.39
LMNA P02545 2/20 0.38
CYP1A2 P05177 2/20 0.38
TSHR P16473 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
MAPK1 P28482 1/20 0.38
NR1H2 P55055 1/20 0.38
RNASEL Q05823 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
CYP3A4 P08684 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
SCHEMBL3910172 0.88 TDP1 (0.44) ESR1LMNACYP1A2CYP2C19SMN1; SMN2
SCHEMBL31148946 0.85 LCK (0.50) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL31148945 0.85 LCK (0.50) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL3846745 0.85 LCK (0.50) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
Di(Hydroxyethyl)Ether SCHEMBL28643732 0.85 LCK (0.51) CYP1A2TSHRLCKFYN
SCHEMBL3138869 0.84 LCK (0.41) LMNALCKFYN
SCHEMBL8442822 0.84 LCK (0.50) ESR1LMNACYP2C19SMN1; SMN2LCK
SCHEMBL7945440 0.83 ESR1 (0.59) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL1603985 0.83 LCK (0.48) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL1602982 0.83 LCK (0.48) ESR1AKR1C4AKR1C3AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5287174-A None JP disclosed
EP-1796114-B1 Composite film for capacitor, method for production thereof and base film therefor TEIJIN LTD (JP) 2009-01-21 EP disclosed
EP-1796114-A2 Composite film for condenser, method for production thereof and base film therefor TEIJIN LIMITED (JP) 2007-06-13 EP disclosed
EP-1113467-B1 COMPOSITE FILM FOR CAPACITOR, METHOD FOR MANUFACTURING THE SAME, AND BASE FILM THEREFOR TEIJIN LTD (JP) 2007-05-16 EP disclosed
EP-1029704-B1 BIAXIALLY ORIENTED POLYESTER FILM FOR RIBBON FOR USE IN THERMAL TRANSFER RECORDING, AND LAMINATED FILM COMPRISING THE SAME AND METHOD FOR MANUFACTURE THEREOF TEIJIN LTD (JP) 2004-12-29 EP disclosed
US-6432509-B1 BIAXIAL ORIENTATION; POLYETHYLENE NAPHTHALENEDICARBOXYLATE OVERCOATED WITH METAL TEIJIN LIMITED (JP) 2002-08-13 US disclosed
US-6303210-B1 RIBBON FOR THERMAL TRANSFER PRINTER; PRINTING PERFORMANCE AND FREE FROM THE TROUBLES OF THIN INK SPOT EVEN IN THE CASE TEIJIN LIMITED (JP) 2001-10-16 US disclosed
EP-1113467-A1 COMPOSITE FILM FOR CAPACITOR, METHOD FOR MANUFACTURING THE SAME, AND BASE FILM THEREFOR TEIJIN LIMITED (JP) 2001-07-04 EP disclosed
JP-2001019735-A POLYURETHANE RESIN AND LEATHERY SHEETLIKE MATERIAL USING THE SAME TEIJIN LTD 2001-01-23 JP disclosed
EP-1029704-A1 BIAXIALLY ORIENTED POLYESTER FILM FOR RIBBON FOR USE IN THERMAL TRANSFER RECORDING, AND LAMINATED FILM COMPRISING THE SAME AND METHOD FOR MANUFACTURE THEREOF TEIJIN LIMITED (JP) 2000-08-23 EP disclosed
JP-H05287174-A MODIFIED POLYESTER COMPOSITION MITSUBISHI RAYON CO LTD 1993-11-02 JP disclosed