SCHEMBL29201414

SCHEMBL29201414

CCCCCCN(C(=O)O)C(F)C(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
CES2 O00748 1/20 0.41
EPHX2 P34913 1/20 0.40
GPR84 Q9NQS5 10/20 0.38
PPARD Q03181 8/20 0.38
PPARG P37231 7/20 0.38
PPARA Q07869 7/20 0.38
HDAC11 Q96DB2 5/20 0.38
TSHR P16473 4/20 0.38
PTPN1 P18031 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TLR2 O60603 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
FABP4 P15090 2/20 0.38
FFAR1 O14842 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
MEN1 O00255 1/20 0.38
ESR1 P03372 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL1759008 0.79 EPHX2 (0.54) EPHX2GPR84PPARDPPARGPPARA
SCHEMBL15224740 0.76 FAAH (0.40) MAPTCES2EPHX2GPR84PPARD
SCHEMBL15225281 0.76 FAAH (0.40) MAPTCES2EPHX2GPR84PPARD
SCHEMBL15224882 0.76 FAAH (0.40) MAPTCES2EPHX2GPR84PPARD
SCHEMBL1416635 0.73 EPHX1 (0.43) EPHX2GPR84PPARDPPARGPPARA
SCHEMBL11355835 0.73 EPHX2 (0.42) EPHX2GPR84PPARDPPARGPPARA
SCHEMBL1416748 0.73 EPHX1 (0.43) EPHX2GPR84PPARDPPARGPPARA
SCHEMBL4247411 0.73 EPHX1 (0.43) EPHX2GPR84PPARDPPARGPPARA
SCHEMBL2641805 0.73 EPHX2 (0.39) EPHX2GPR84PPARDPPARGPPARA
SCHEMBL6548976 0.71 GPR84 (0.39) MAPTEPHX2GPR84FFAR1MEN1

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
CN-117813334-A Onium salt, blocking agent dissociation catalyst for blocking isocyanate, blocked isocyanate composition containing blocking agent dissociation catalyst, thermosetting resin composition, cured product, and method for producing same 广荣化学株式会社 2024-04-02 CN disclosed