SCHEMBL9587790

SCHEMBL9587790

CC(C)COCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2C9 P11712 1/20 0.40
RECQL P46063 1/20 0.40
MAPT P10636 2/20 0.39
USP2 O75604 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL11511024 0.84 MAPT (0.45) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL3418029 0.84 MAPT (0.45) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL25980249 0.82 CYP1A2 (0.39) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL9588106 0.81 CYP1A2 (0.42) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL13096919 0.81 CYP1A2 (0.42) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL25980346 0.80 LMNA (0.38) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL2867590 0.79 LMNA (0.43) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL2865122 0.79 LMNA (0.43) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL2864128 0.79 LMNA (0.43) CYP1A2CYP2C19CYP2C9RECQLMAPT
SCHEMBL16939054 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0077114-B1 PERFLUOROCHEMICALS, PROCESS FOR PREPARING THE SAME AND THEIR USE AS BLOOD SUBSTITUTES GREEN CROSS CORPORATION (JP) 1987-12-02 EP claimed
EP-0077114-A1 Perfluorochemicals, process for preparing the same and their use as blood substitutes GREEN CROSS CORPORATION (JP) 1983-04-20 EP claimed
US-5214214-A Blood substitute THE GREEN CROSS CORPORATION (JP) 1993-05-25 US disclosed
US-4943595-A PERFLUOROALKYL ETHERS, BLOOD SUBSTITUTES THE GREEN CROSS CORPORATION (JP) 1990-07-24 US disclosed
EP-0077114-B1 PERFLUOROCHEMICALS, PROCESS FOR PREPARING THE SAME AND THEIR USE AS BLOOD SUBSTITUTES GREEN CROSS CORPORATION (JP) 1987-12-02 EP disclosed
EP-0077114-A1 Perfluorochemicals, process for preparing the same and their use as blood substitutes GREEN CROSS CORPORATION (JP) 1983-04-20 EP disclosed