SCHEMBL28512862

SCHEMBL28512862

O=C(OC1CCCCC1)C1CCC23OC2(C1)O3

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
EPHX1 P07099 2/20 0.35
NAAA Q02083 2/20 0.34
HTT P42858 1/20 0.33
FABP7 O15540 1/20 0.33
FABP5 Q01469 1/20 0.33
CYP19A1 P11511 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL2678468 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL170007 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL5953668 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL3839481 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL17061158 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL24595803 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL17061159 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL11038809 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL1296389 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7
SCHEMBL27680260 0.72 EPHX1 (0.48) CYP2C19EPHX1NAAAHTTFABP7

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-104945821-B Light-cured resin and preparation method thereof 大族激光科技产业集团股份有限公司 2018-08-10 CN claimed
CN-106632895-A 3D printing light-cured resin composition activated by epoxidized limonene 王璟 2017-05-10 CN claimed
CN-107850865-B Electrophotographic composition 惠普印迪戈股份公司 2021-01-19 CN disclosed
CN-104945821-B Light-cured resin and preparation method thereof 大族激光科技产业集团股份有限公司 2018-08-10 CN disclosed
CN-106632895-A 3D printing light-cured resin composition activated by epoxidized limonene 王璟 2017-05-10 CN disclosed