SCHEMBL4641491

SCHEMBL4641491

O=C(CCCO)C(=O)C(Cl)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CES2 O00748 4/20 0.37
CES1 P23141 4/20 0.37
ALDH1A1 P00352 2/20 0.37
CCR3 P51677 1/20 0.36
SRC P12931 2/20 0.35
CYP2D6 P10635 1/20 0.35
LMNA P02545 3/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.34
CAMK2A Q9UQM7 1/20 0.34
MAPK1 P28482 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
SCHEMBL4642378 0.95 MEN1 (0.38) MEN1KMT2ACES2CES1ALDH1A1
SCHEMBL4645492 0.89 MEN1 (0.41) MEN1KMT2ACES2CES1SRC
SCHEMBL4645376 0.86 SMN1; SMN2 (0.39) MEN1KMT2ACES2CES1ALDH1A1
SCHEMBL4646119 0.85 SMN1; SMN2 (0.38) MEN1KMT2ACES2CES1SRC
SCHEMBL27619985 0.85 CES2 (0.36) MEN1KMT2ACES2CES1SRC
SCHEMBL4643576 0.82 TDP1 (0.42) CES2CES1ALDH1A1CCR3SRC
SCHEMBL4644194 0.82 LMNA (0.41) MEN1KMT2ACES2CES1ALDH1A1
SCHEMBL4647061 0.82 CES2 (0.42) MEN1KMT2ACES2CES1ALDH1A1
SCHEMBL4643773 0.80 HTT (0.36) ALDH1A1CCR3
SCHEMBL4644176 0.79 CES2 (0.60) CES2CES1ALDH1A1CCR3SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN 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