SCHEMBL4239236

SCHEMBL4239236

O=C(O)CC(Cc1ccccc1)(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.46
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
LMNA P02545 1/20 0.45
ESR1 P03372 7/20 0.42
ESR2 Q92731 7/20 0.42
HIF1A Q16665 2/20 0.42
CYP2C19 P33261 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA2 P00918 1/20 0.41
CAMK2A Q9UQM7 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41
BLM P54132 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
AKR1B1 P15121 1/20 0.39

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
SCHEMBL6250499 0.89 CYP2C19 (0.52) KIF11HIF1ACYP2C19SMN1; SMN2ALDH1A1
SCHEMBL68967 0.85 KIF11 (0.51) KIF11FNTAFNTBLMNAESR1
SCHEMBL311875 0.79 ESR1 (0.64) KIF11ESR1ESR2CYP2C19ALDH1A1
SCHEMBL2229415 0.77 ESR1 (0.45) KIF11LMNAESR1ESR2HIF1A
SCHEMBL9516998 0.76 ESR1 (0.51) KIF11LMNAESR1ESR2CA2
SCHEMBL5522093 0.75 ESR1 (0.52) KIF11LMNAESR1ESR2HIF1A
SCHEMBL27737601 0.75 HIF1A (0.48) KIF11HIF1ACYP2C19SMN1; SMN2ALDH1A1
SCHEMBL2291376 0.75 SMN1; SMN2 (0.48) KIF11FNTAFNTBLMNAESR1
SCHEMBL6842047 0.75 ESR1 (0.61) LMNAESR1ESR2CYP3A4BLM
SCHEMBL6368028 0.75 CYP2C19 (0.61) KIF11HIF1ACYP2C19ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1816003-B1 Method for producing a thermosensitive recording material RICOH KK (JP) 2009-08-26 EP disclosed
US-20070184978-A1 Thermosensitive recording material and method of producing the same RICOH COMPANY, LTD. (JP) 2007-08-09 US disclosed
EP-1816003-A1 Thermosensitive recording material and method for producing the same Ricoh Company, Ltd. (JP) 2007-08-08 EP disclosed