SCHEMBL22242513

SCHEMBL22242513

CCOC(=O)C(c1cccc(Br)c1)C(C(=O)OCC)c1cccc(Br)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.47
ALDH1A1 P00352 4/20 0.45
MAPT P10636 2/20 0.45
HPGD P15428 1/20 0.44
CTSA P10619 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GAA P10253 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PARP1 P09874 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL20930939 0.94 ALDH1A1 (0.47) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL20930559 0.91 ALDH1A1 (0.43) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL290364 0.88 MMP8 (0.54) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL29824513 0.88 MMP8 (0.54) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL13523030 0.87 MMP8 (0.45) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL27796403 0.87 MMP8 (0.45) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL11189555 0.87 ALDH1A1 (0.46) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL2141939 0.85 MMP8 (0.44) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL15270484 0.85 MMP8 (0.44) MMP8ALDH1A1MAPTHPGDCTSA
SCHEMBL31198087 0.85 MMP8 (0.44) MMP8ALDH1A1MAPTHPGDCTSA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200235304-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-07-23 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 (1 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-20200235304-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME C1S, CBR3, CCNL2 MMP8 4825/4885ALDH1A1 979/4885MAPT 4043/4885

“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.