SCHEMBL4644556

SCHEMBL4644556

Cc1ccc([SiH2]OC(=O)C(C)(C(=O)O[SiH2]c2ccc(C)cc2)C(=O)O[SiH2]c2ccc(C)cc2O)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
CSNK2A1 P68400 1/20 0.32
KMT2A Q03164 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
SCHEMBL4642545 0.85 RAB9A (0.36) ALDH1A1KDM4ELMNANPC1RAB9A
SCHEMBL4643854 0.73 ALDH1A1 (0.37) ALDH1A1GAALMNANPSR1TDP1
SCHEMBL4643587 0.71 ALDH1A1 (0.34) ALDH1A1GAALMNANPSR1TDP1
SCHEMBL4647341 0.71 ALDH1A1 (0.34) ALDH1A1GAALMNANPSR1TDP1
SCHEMBL4642079 0.68 ALDH1A1 (0.33) ALDH1A1GAATDP1NPC1POLB
SCHEMBL4645470 0.67 LMNA (0.32) ALDH1A1LMNATDP1NPC1RAB9A
SCHEMBL4645863 0.65 LMNA (0.30) LMNATDP1
SCHEMBL4643335 0.65 ALDH1A1 (0.38) ALDH1A1GAAKDM4ELMNANPSR1
SCHEMBL6555621 0.61 LMNA (0.36) ALDH1A1GAALMNATDP1NPC1
Bicarbonate SCHEMBL11751889 0.58 ALDH1A1 (0.50) TRPA1ALDH1A1GAAKDM4ELMNA

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