SCHEMBL805442

SCHEMBL805442

CCCCOc1ccc2c(c1)COc1cc(O)ccc1-2

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
ALDH1A1 P00352 1/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ESR1 P03372 5/20 0.44
ESR2 Q92731 5/20 0.44
LTA4H P09960 2/20 0.44
NR5A1 Q13285 1/20 0.44
MAOB P27338 3/20 0.44
AAK1 Q2M2I8 2/20 0.42
THRA P10827 2/20 0.41
THRB P10828 2/20 0.41
MAOA P21397 2/20 0.41

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
SCHEMBL805440 0.85 MAOB (0.45) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL802622 0.82 MAOB (0.57) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL803144 0.81 MAOB (0.66) NPC1ALDH1A1MAPTRAB9AMAOB
SCHEMBL805443 0.78 MAOB (0.44) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL30577530 0.78 MAOA (0.49) ALDH1A1MAPTRAB9AESR1ESR2
SCHEMBL802750 0.78 MAOA (0.49) ALDH1A1MAPTRAB9AESR1ESR2
SCHEMBL19310351 0.77 ROCK2 (0.59) AAK1
SCHEMBL8385525 0.77 MEN1 (0.59) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL26768220 0.74 MAOB (0.42) MEN1ALDH1A1MAPTRAB9AKMT2A
SCHEMBL13264370 0.73 MAOB (0.69) MEN1NPC1ALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096795-B2 Liquid crystal display MERCK PATENT GMBH (DE) 2015-08-04 US disclosed
EP-2432851-B1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2013-10-02 EP disclosed
US-20120069289-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-22 US disclosed
WO-2010133278-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2010-11-25 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 (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-20120069289-A1 LIQUID CRYSTAL DISPLAY LPXN, VCL, ACP3 MEN1 2525/4885NPC1 4142/4885ALDH1A1 3543/4885

“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.