SCHEMBL4644034

SCHEMBL4644034

CCC[CH]C(=O)Oc1ccc(OC)cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 4/20 0.49
ERN1 O75460 5/20 0.48
TRIM24 O15164 1/20 0.44
TYR P14679 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
JUN P05412 1/20 0.43
NFKB1 P19838 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
TUBB1 Q9H4B7 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 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
SCHEMBL4642355 0.89 KDM4E (0.52) KDM4ERAB9AALDH1A1ERN1TRIM24
SCHEMBL4641754 0.85 CA12 (0.49) ALDH1A1JUNNFKB1TDP1ABCG2
SCHEMBL4644460 0.82 PTGDR2 (0.52) KDM4EALDH1A1ERN1TDP1L3MBTL1
SCHEMBL4645650 0.81 ALDH1A1 (0.56) KDM4ERAB9AALDH1A1ERN1TRIM24
SCHEMBL4644428 0.81 CREBBP (0.40) ALDH1A1TDP1
SCHEMBL4642014 0.80 PTGDR2 (0.49) ALDH1A1ERN1TDP1LMNACYP1A2
SCHEMBL4645454 0.80 TDP1 (0.40) KDM4EALDH1A1TDP1ABCG2LMNA
SCHEMBL16112011 0.79 ALDH1A1 (0.61) KDM4ERAB9AALDH1A1ERN1TRIM24
SCHEMBL4642186 0.79 THRB (0.45) LMNACYP1A2CYP2C9CYP2C19
SCHEMBL16045979 0.78 ALDH1A1 (0.59) KDM4ERAB9AALDH1A1ERN1TRIM24

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