SCHEMBL8747166

SCHEMBL8747166

C=C(CCCCCC)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.42
CES1 P23141 10/20 0.42
CES2 O00748 5/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
GPR84 Q9NQS5 2/20 0.34
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
TLR2 O60603 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL26274907 0.84 FAAH (0.45) FAAHCES1CES2MEN1CYP1A2
SCHEMBL28291216 0.84 THRB (0.34)
SCHEMBL28309481 0.82 THRB (0.38)
SCHEMBL8767563 0.78 FAAH (0.44) FAAHCES1CES2MEN1CYP1A2
SCHEMBL7180675 0.78 FAAH (0.47) FAAHCES1CES2MEN1CYP1A2
SCHEMBL19263856 0.77 FAAH (0.56) FAAHCES1CES2MEN1CYP1A2
SCHEMBL20973216 0.77 FAAH (0.56) FAAHCES1CES2MEN1CYP1A2
SCHEMBL21801450 0.76 FAAH (0.41) FAAHCES1CES2MEN1CYP1A2
SCHEMBL26273513 0.74 FAAH (0.54) FAAHCES1CES2MEN1CYP1A2
Perflenapent SCHEMBL8935098 0.73 TSHR (0.50) FAAHCES1CES2MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0515676-B1 SYSTEM FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS MALLINCKRODT MEDICAL INC (US) 1997-03-12 EP claimed
US-5213570-A System and method for oxygenation of the pericardium MALLINCKRODT MEDICAL, INC. (US) 1993-05-25 US claimed
EP-0515676-A1 SYSTEM AND METHOD FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS. MALLINCKRODT MEDICAL INC (US) 1992-12-02 EP claimed
US-5137510-A SYSTEM AND METHOD FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS MALLINCKRODT MEDICAL, INC. (US) 1992-08-11 US claimed
WO-1992010221-A2 SYSTEM AND METHOD FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS MALLINCKRODT MEDICAL, INC. (US) 1992-06-25 WO claimed
EP-0515676-B1 SYSTEM FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS MALLINCKRODT MEDICAL INC (US) 1997-03-12 EP disclosed
US-5213570-A System and method for oxygenation of the pericardium MALLINCKRODT MEDICAL, INC. (US) 1993-05-25 US disclosed
EP-0515676-A1 SYSTEM AND METHOD FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS. MALLINCKRODT MEDICAL INC (US) 1992-12-02 EP disclosed
US-5137510-A SYSTEM AND METHOD FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS MALLINCKRODT MEDICAL, INC. (US) 1992-08-11 US disclosed
WO-1992010221-A2 SYSTEM AND METHOD FOR OXYGENATION OF THE HEART USING SUBPERICARDIAL FLUIDS MALLINCKRODT MEDICAL, INC. (US) 1992-06-25 WO disclosed