SCHEMBL4646519

SCHEMBL4646519

O=C(CCCO)C(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.42
ATR Q13535 1/20 0.34
FAAH O00519 8/20 0.33
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CES1 P23141 6/20 0.32
CES2 O00748 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL4644076 0.93 GPR84 (0.42) CAMK2AATRFAAHGPR84FFAR1
SCHEMBL4641469 0.84 FAAH (0.31) FAAHCES1CES2MEN1KMT2A
SCHEMBL4646118 0.78 FAAH (0.32) FAAHCES1CES2MEN1KMT2A
SCHEMBL4643620 0.76 FAAH (0.35) FAAHCES1CES2MEN1KMT2A
SCHEMBL4643614 0.75 CAMK2A (0.42) CAMK2AGPR84FFAR1FFAR4CES1
SCHEMBL4643862 0.75 CAMK2A (0.42) CAMK2AGPR84FFAR1FFAR4CES1
SCHEMBL4645993 0.75 CAMK2A (0.42) CAMK2AGPR84FFAR1FFAR4CES1
SCHEMBL29794313 0.75 CES1 (0.63) FAAHCES1CES2MEN1KMT2A
SCHEMBL1334928 0.75 CES1 (0.63) FAAHCES1CES2MEN1KMT2A
SCHEMBL20163309 0.74 CAMK2A (0.59) CAMK2AGPR84FFAR1FFAR4CES1

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-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed