SCHEMBL4644720

SCHEMBL4644720

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

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.59
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
MTNR1A P48039 2/20 0.52
MTNR1B P49286 2/20 0.52
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50
TUBA4A P68366 1/20 0.50
TUBB4B P68371 1/20 0.50
TUBB3 Q13509 1/20 0.50
TUBB2A Q13885 1/20 0.50
TUBB8 Q3ZCM7 1/20 0.50
TUBA3E Q6PEY2 1/20 0.50
TUBA1A Q71U36 1/20 0.50

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
SCHEMBL4647806 0.93 TUBB4A (0.57) TOP2ACA12CA1CA2CA7
SCHEMBL4646609 0.87 CA12 (0.52) TOP2ACA12CA1CA2CA7
SCHEMBL4642607 0.85 MTNR1A (0.48) TOP2AMTNR1AMTNR1BTUBB4ATUBB
SCHEMBL27728359 0.85 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL4644084 0.85 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL4642142 0.84 CA12 (0.49) TOP2ACA12CA1CA2CA7
SCHEMBL5842586 0.83 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL11576231 0.83 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL4645740 0.83 CA12 (0.55) TOP2ACA12CA1CA2CA7
SCHEMBL4644306 0.83 TOP2A (0.48) TOP2ACA12CA1CA2CA7

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