SCHEMBL21767944

SCHEMBL21767944

CC(C)CCOC(=O)/C=C\C(=O)O.CC(C)[SiH](C(C)C)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 10/20 0.53
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 1/20 0.44
ATM Q13315 1/20 0.39
MAPK1 P28482 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PPARG P37231 1/20 0.33
CYP19A1 P11511 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL3482913 0.91 HCAR2 (0.62) HCAR2TDP1LMNAATMCA12
SCHEMBL30115053 0.91 HCAR2 (0.62) HCAR2TDP1LMNAATMCA12
SCHEMBL3482909 0.91 HCAR2 (0.62) HCAR2TDP1LMNAATMCA12
Propane SCHEMBL7773741 0.88 HCAR2 (0.63) HCAR2TDP1LMNAATMCA12
SCHEMBL2475186 0.84 TDP1 (0.56) HCAR2TDP1LMNAATMMAPK1
SCHEMBL2475190 0.84 TDP1 (0.56) HCAR2TDP1LMNAATMMAPK1
SCHEMBL2478667 0.84 TDP1 (0.56) HCAR2TDP1LMNAATMMAPK1
SCHEMBL1408806 0.81 HCAR2 (0.65) HCAR2TDP1LMNAATM
SCHEMBL11685039 0.81 HCAR2 (0.65) HCAR2TDP1LMNAATM
SCHEMBL1408812 0.81 HCAR2 (0.65) HCAR2TDP1LMNAATM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3617240-B1 VEHICLE RESIN FOR AN ANTIFOULING COATING NIPPON PAINT MARINE COATINGS CO LTD (JP) 2021-12-01 EP disclosed
US-11111406-B2 Copolymer and antifouling coating composition containing the same NIPPON PAINT MARINE COATINGS CO., LTD. (JP) 2021-09-07 US disclosed
US-20210024770-A1 COPOLYMER AND ANTIFOULING COATING COMPOSITION CONTAINING THE SAME NIPPON PAINT MARINE COATINGS CO., LTD. (JP) 2021-01-28 US disclosed
EP-3617240-A1 COPOLYMER AND ANTI-FOULING PAINT COMPOSITION CONTAINING SAME Nippon Paint Marine Coatings Co., Ltd. (JP) 2020-03-04 EP disclosed