SCHEMBL20599232

SCHEMBL20599232

COC(=O)Cc1cc(Br)c(O)c(C(C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.51
VCAM1 P19320 1/20 0.43
GAA P10253 6/20 0.42
ALDH1A1 P00352 5/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 4/20 0.40
TSHR P16473 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
MAPK1 P28482 2/20 0.40
BLM P54132 2/20 0.40
ATM Q13315 2/20 0.40
HIF1A Q16665 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
USP2 O75604 1/20 0.40
CYP2D6 P10635 1/20 0.40
LMNA P02545 3/20 0.39
PTGS1 P23219 1/20 0.39

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
SCHEMBL6858351 0.89 HSP90AB1 (0.59) HSP90AB1VCAM1GAAALDH1A1GFER
SCHEMBL2786552 0.85 HSP90AB1 (0.63) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL28118610 0.81 HSP90AB1 (0.58) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL29961027 0.81 HSP90AB1 (0.58) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL7069525 0.80 HSP90AB1 (0.56) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL20599348 0.79 HSP90AB1 (0.42) HSP90AB1VCAM1GAAALDH1A1GFER
SCHEMBL31075998 0.78 HSP90AB1 (0.54) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL7073645 0.78 HSP90AB1 (0.54) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL1525224 0.78 HSP90AB1 (0.54) HSP90AB1GAAALDH1A1GFERKMT2A
SCHEMBL21553597 0.78 GAA (0.50) VCAM1GAAALDH1A1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3645532-B9 HYDROXYPHENYL PHENANTHROLINES AS POLYMERIZABLE BLOCKERS OF HIGH ENERGY LIGHT FOR PREPARING OPHTHALMIC DEVICES, SUCH AS E.G. CONTACT LENSES JOHNSON & JOHNSON VISION CARE (US) 2022-08-31 EP disclosed
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
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
US-10723732-B2 Hydroxyphenyl phenanthrolines as polymerizable blockers of high energy light JOHNSON & JOHNSON VISION CARE, INC. (US) 2020-07-28 US disclosed
US-20190002459-A1 HYDROXYPHENYL PHENANTHROLINES AS POLYMERIZABLE BLOCKERS OF HIGH ENERGY LIGHT JOHNSON & JOHNSON VISION CARE, INC. 2019-01-03 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190002459-A1 HYDROXYPHENYL PHENANTHROLINES AS POLYMERIZABLE BLOCKERS OF HIGH ENERGY LIGHT HRH2, HRH3, HRH1 HSP90AB1 51/4885VCAM1 1137/4885GAA 3475/4885
US-10723732-B2 Hydroxyphenyl phenanthrolines as polymerizable blockers of high energy light HRH2, HRH3, HRH1 HSP90AB1 51/4885VCAM1 1137/4885GAA 3475/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.