SCHEMBL3609274

SCHEMBL3609274

CCOc1ccc(-c2ccccc2)c(C=O)c1O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 9/20 0.52
ALDH1A1 P00352 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GLA P06280 1/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
PTPRC P08575 1/20 0.38

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
SCHEMBL3614065 0.86 ERN1 (0.51) ERN1ALDH1A1L3MBTL1MAPTNPSR1
SCHEMBL3614027 0.85 ERN1 (0.55) ERN1ALDH1A1MAPTKDM4ENPSR1
SCHEMBL3618296 0.85 ERN1 (0.56) ERN1ALDH1A1MAPTKDM4EADORA3
SCHEMBL29672058 0.84 ERN1 (0.44) ERN1ALDH1A1L3MBTL1GLAMAPT
SCHEMBL28792533 0.84 ERN1 (0.44) ERN1ALDH1A1L3MBTL1GLAMAPT
SCHEMBL3603939 0.84 ERN1 (0.48) ERN1ALDH1A1MAPT
SCHEMBL12766888 0.83 ERN1 (0.73) ERN1MAPTKDM4E
SCHEMBL3613315 0.83 ERN1 (0.56) ERN1
SCHEMBL3618769 0.82 ERN1 (0.51) ERN1ALDH1A1MAPT
SCHEMBL3604651 0.82 ERN1 (0.43) ERN1ALDH1A1L3MBTL1KDM4EPTPRC

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
US-20100249165-A1 PDZ DOMAIN MODULATORS UNIVERSITY OF COPENHAGEN (DK) 2010-09-30 US claimed
EP-2164478-A2 PDZ DOMAIN MODULATORS University of Copenhagen (DK) 2010-03-24 EP claimed
WO-2008148747-A2 PDZ DOMAIN MODULATORS UNIVERSITY OF COPENHAGEN (DK) 2008-12-11 WO claimed
US-20100249165-A1 PDZ DOMAIN MODULATORS UNIVERSITY OF COPENHAGEN (DK) 2010-09-30 US disclosed
EP-2164478-A2 PDZ DOMAIN MODULATORS University of Copenhagen (DK) 2010-03-24 EP disclosed
WO-2008148747-A2 PDZ DOMAIN MODULATORS UNIVERSITY OF COPENHAGEN (DK) 2008-12-11 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-20100249165-A1 PDZ DOMAIN MODULATORS PDLIM5, PSD, PDCD6IP ERN1 2349/4885ALDH1A1 3764/4885L3MBTL1 772/4885

“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.