SCHEMBL4643620

SCHEMBL4643620

O=C(CCCCCl)C(=O)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.35
CES1 P23141 9/20 0.34
CES2 O00748 6/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

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
SCHEMBL4646118 0.93 FAAH (0.32) FAAHCES1CES2MEN1CYP1A2
SCHEMBL4645307 0.83 FAAH (0.30) FAAH
SCHEMBL4644264 0.79 CES2 (0.33) FAAHCES1CES2
SCHEMBL4644076 0.79 GPR84 (0.42) FAAHCES1CES2MEN1CYP1A2
SCHEMBL4647229 0.77 CES1 (0.37) FAAHCES1CES2
SCHEMBL4644333 0.77 CES2 (0.32) CES1CES2
SCHEMBL4646519 0.76 CAMK2A (0.42) FAAHCES1CES2MEN1CYP1A2
SCHEMBL1334928 0.76 CES1 (0.63) FAAHCES1CES2MEN1CYP1A2
SCHEMBL29794313 0.76 CES1 (0.63) FAAHCES1CES2MEN1CYP1A2
SCHEMBL31636122 0.74 FAAH (0.61) 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 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