SCHEMBL4644306

SCHEMBL4644306

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

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 5/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL4642142 0.96 CA12 (0.49) TOP2ACA12CA1CA2CA7
SCHEMBL4646609 0.90 CA12 (0.52) TOP2ACA12CA1CA2CA7
SCHEMBL4641806 0.87 TDP1 (0.43) LMNAHTTSMN1; SMN2HSD17B10KMT2A
SCHEMBL4642297 0.87 TOP2A (0.49) TOP2ACA12CA1CA2CA7
SCHEMBL27601401 0.86 CA12 (0.47) TOP2ACA12CA1CA2CA7
SCHEMBL4643648 0.85 CA12 (0.50) TOP2ACA12CA1CA2CA7
SCHEMBL4641759 0.84 CA12 (0.49) TOP2ACA12CA1CA2CA7
SCHEMBL4641857 0.84 KDM4E (0.51) TOP2ALMNAHTTSMN1; SMN2KMT2A
SCHEMBL4644720 0.83 TOP2A (0.59) TOP2ACA12CA1CA2CA7
SCHEMBL4646842 0.83 TDP1 (0.44) LMNAHTTSMN1; SMN2HSD17B10KMT2A

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