SCHEMBL20620697

SCHEMBL20620697

COCOc1c(B2OC(C)(C)C(C)(C)O2)cc(CC(=O)OC)cc1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.35
HSP90AB1 P08238 1/20 0.35
HIF1A Q16665 1/20 0.32
VCAM1 P19320 1/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL29605695 0.79 HIF1A (0.32) HIF1A
SCHEMBL23092070 0.78 LPL (0.31)
SCHEMBL23092074 0.78 CA1 (0.36)
SCHEMBL20599348 0.77 HSP90AB1 (0.42) HSP90AB1VCAM1LMNAMAPTSMN1; SMN2
SCHEMBL1303608 0.74 HSP90AB1 (0.32) HSP90AB1
SCHEMBL29714911 0.74 PIM1 (0.33) DGAT1
SCHEMBL22321069 0.70
SCHEMBL26787616 0.70 HIF1A (0.30) HIF1A
SCHEMBL15185134 0.70 ALDH1A1 (0.43) HSP90AB1HIF1AMAPTSMN1; SMN2
SCHEMBL136786 0.69 GAA (0.43) HSP90AB1HIF1AMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3645532-B1 HYDROXYPHENYL PHENANTHROLINES AS POLYMERIZABLE BLOCKERS OF HIGH ENERGY LIGHT FOR PREPARING OPHTHALMIC DEVICES, SUCH AS E.G. CONTACT LENSES JOHNSON & JOHNSON VISION CARE (US) 2022-05-11 EP disclosed
WO-2019003064-A1 HYDROXYPHENYL PHENANTHROLINES AS POLYMERIZABLE BLOCKERS OF HIGH ENERGY LIGHT FOR PREPARING OPHTHALMIC DEVICES, SUCH AS E.G. CONTACT LENSES JOHNSON & JOHNSON VISION CARE, INC. (US) 2019-01-03 WO disclosed