SCHEMBL6722688

SCHEMBL6722688

FC(=COC(F)(F)F)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.43
CES2 O00748 2/20 0.34
PTPN1 P18031 1/20 0.33
ESR1 P03372 1/20 0.33
ABCC9 O60706 2/20 0.33
ABCC8 Q09428 2/20 0.33
KCNJ11 Q14654 2/20 0.33
PDK1 Q15118 2/20 0.33
PDK2 Q15119 2/20 0.33
PDK3 Q15120 2/20 0.33
KCNJ8 Q15842 2/20 0.33
PDK4 Q16654 2/20 0.33
MLYCD O95822 1/20 0.33
ABCB11 O95342 1/20 0.33
F2 P00734 1/20 0.32
LMNA P02545 1/20 0.32
GRIN2B Q13224 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32

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
SCHEMBL4649015 0.79 AKR1C1 (0.48) CES1CES2F2LMNAAKR1C1
SCHEMBL27591267 0.78 NR4A1 (0.41) CES1CES2ESR1ABCC9ABCC8
SCHEMBL7149428 0.72 CES1 (0.41) CES1CES2ABCC9ABCC8KCNJ11
SCHEMBL27744497 0.71 MAPT (0.44) CES1LMNAALDH1A1MAPK1TDP1
SCHEMBL3523456 0.69 ALDH1A1 (0.48) CES1CES2F2LMNACYP1A1
SCHEMBL4139246 0.69 CES1 (0.38) CES1CES2F2LMNAAKR1C1
SCHEMBL4135542 0.68 ALDH1A1 (0.38) CES1CES2F2LMNAAKR1C1
SCHEMBL4139249 0.68 CES1 (0.36) CES1CES2F2LMNAAKR1C1
SCHEMBL31423435 0.68 NPSR1 (0.33) CES1MLYCD
SCHEMBL16933937 0.67 CES1 (0.39) CES1CES2F2AKR1C1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6673523-B2 APPLYING PHOTORESIST FILM TO SEMICONDUCTOR SUBSTRATE; IRRADIATION; DEVELOPMENT MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2004-01-06 US disclosed