SCHEMBL4642367

SCHEMBL4642367

CC[CH]C(=O)Oc1c(C=O)cccc1OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MAPK1 P28482 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
SRC P12931 1/20 0.40
TLR2 O60603 1/20 0.39
ERN1 O75460 1/20 0.39
TLR1 Q15399 1/20 0.39
TLR6 Q9Y2C9 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL4647884 0.89 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL4641676 0.87 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL4644871 0.87 SRC (0.54) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL6553840 0.84 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL6553836 0.83 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL4645166 0.82 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL4642393 0.81 CA1 (0.57) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL4646424 0.81 ERN1 (0.45) ALDH1A1SMN1; SMN2MEN1KMT2ANPC1
SCHEMBL4641996 0.81 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL4641679 0.81 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A

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