SCHEMBL4644728

SCHEMBL4644728

CC[CH]C(=O)Oc1ccc(C(C)=O)cc1C=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.42
ALDH1A1 P00352 6/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
HPGD P15428 1/20 0.36
GAA P10253 1/20 0.36
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL4644428 0.89 CREBBP (0.40) CREBBPALDH1A1HIF1ATDP1KMT2A
SCHEMBL4641834 0.84 TDP1 (0.41) CREBBPALDH1A1HIF1ATDP1KMT2A
SCHEMBL4641637 0.82 TSHR (0.50) CREBBPALDH1A1TDP1KMT2AMEN1
SCHEMBL4644283 0.81 PTGDR2 (0.55) ALDH1A1TDP1KMT2AMEN1HPGD
SCHEMBL4642355 0.80 KDM4E (0.52) ALDH1A1TDP1
SCHEMBL4641633 0.79 CREBBP (0.40) CREBBPALDH1A1HIF1ATDP1KMT2A
SCHEMBL4647755 0.79 ALDH1A1 (0.52) ALDH1A1TDP1KMT2AMEN1HPGD
SCHEMBL4641836 0.78 CREBBP (0.40) CREBBPALDH1A1HIF1ATDP1KMT2A
SCHEMBL1706804 0.77 ALDH1A1 (0.51) CREBBPALDH1A1TDP1KMT2AMEN1
SCHEMBL4644730 0.76 CREBBP (0.38) CREBBPALDH1A1HIF1ATDP1KMT2A

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