SCHEMBL4644737

SCHEMBL4644737

COC(=O)/C=C\C(=O)OC(CCC(=O)OC(C)=O)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.40
HCAR2 Q8TDS4 1/20 0.40
CTSL P07711 5/20 0.38
CTSB P07858 3/20 0.38
ACE P12821 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
CTRB1 P17538 1/20 0.35
CTSH P09668 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
SCHEMBL4642043 1.00 CTSK (0.40) CTSKHCAR2CTSLCTSBACE
SCHEMBL4643584 0.76 MAPT (0.45) CTSKHCAR2CTSLCTSB
SCHEMBL4647597 0.76 MAPT (0.45) CTSKHCAR2CTSLCTSB
SCHEMBL7146652 0.73 HCAR2 (0.57) CTSKHCAR2CTSLCTSBTAAR1
SCHEMBL28500285 0.73 HCAR2 (0.57) CTSKHCAR2CTSLCTSBTAAR1
SCHEMBL1114427 0.72 CPA3 (0.54) CTSK
SCHEMBL8919946 0.70 MMP12 (0.45) CTSKCTSLCTSBACE
SCHEMBL8919952 0.70 MMP12 (0.45) CTSKCTSLCTSBACE
SCHEMBL4644734 0.69 TDP1 (0.44) HCAR2CTSL
SCHEMBL4642037 0.69 TDP1 (0.44) HCAR2CTSL

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