SCHEMBL20599348

SCHEMBL20599348

COCOc1c(Br)cc(CC(=O)OC)cc1C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.42
THRB P10828 6/20 0.40
THRA P10827 5/20 0.38
VCAM1 P19320 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34

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
SCHEMBL20599232 0.79 HSP90AB1 (0.51) HSP90AB1VCAM1ALOX15TSHRLMNA
SCHEMBL20620697 0.77 DGAT1 (0.35) HSP90AB1VCAM1LMNAMAPTSMN1; SMN2
SCHEMBL28680697 0.75 HSP90AB1 (0.56) HSP90AB1THRBTHRAALOX15TSHR
SCHEMBL6033258 0.74 ALDH1A1 (0.36) ALDH1A1
SCHEMBL28734927 0.74 CA2 (0.46) MAPTKDM4EKMT2AALDH1A1GAA
SCHEMBL5086986 0.74 CYP2D6 (0.38) HSD17B10LMNAMAPTSMN1; SMN2KDM4E
SCHEMBL13148462 0.74 HSP90AB1 (0.45) HSP90AB1VCAM1TSHRLMNAMAPT
SCHEMBL6858351 0.74 HSP90AB1 (0.59) HSP90AB1VCAM1ALOX15TSHRLMNA
SCHEMBL13170232 0.73 HSP90AB1 (0.47) HSP90AB1VCAM1TSHRLMNAMAPT
SCHEMBL28734957 0.73 HTR2A (0.30)

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
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

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 51/4885THRB 2569/4885THRA 2655/4885
US-10723732-B2 Hydroxyphenyl phenanthrolines as polymerizable blockers of high energy light HRH2, HRH3, HRH1 HSP90AB1 51/4885THRB 2569/4885THRA 2655/4885

“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.