SCHEMBL4642297

SCHEMBL4642297

COc1ccc(OC(=O)CCCCO)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL4643648 0.95 CA12 (0.50) TOP2ACA12CA1CA2CA7
SCHEMBL4642618 0.89 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL4644306 0.87 TOP2A (0.48) TOP2ACA12CA1CA2CA7
SCHEMBL4644809 0.86 TDP1 (0.43) TOP2AHTTLMNASMN1; SMN2HSD17B10
SCHEMBL4642142 0.85 CA12 (0.49) TOP2ACA12CA1CA2CA7
SCHEMBL4641759 0.85 CA12 (0.49) TOP2ACA12CA1CA2CA7
SCHEMBL27601401 0.84 CA12 (0.47) TOP2ACA12CA1CA2CA7
SCHEMBL15557823 0.84 ALOX15 (0.62) TOP2ASMN1; SMN2ALOX15KMT2A
SCHEMBL16436960 0.83 TOP2A (0.51) TOP2ACA12CA1CA2CA7
SCHEMBL4641648 0.83 KDM4E (0.49) TOP2ALMNAALOX15KMT2AALDH1A1

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