SCHEMBL20181893

SCHEMBL20181893

c1ccc(Nc2cccc3oc4ccccc4c23)c(Nc2cccc3oc4ccccc4c23)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
ALDH1A1 P00352 5/20 0.45
KDM4E B2RXH2 4/20 0.45
HPGD P15428 4/20 0.45
MAOA P21397 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
GLA P06280 3/20 0.45
CYP3A4 P08684 1/20 0.45
PGAM1 P18669 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
HSD17B10 Q99714 1/20 0.45
LMNA P02545 2/20 0.44
CDC14B O60729 1/20 0.41
CDC14A Q9UNH5 1/20 0.41
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
GAA P10253 2/20 0.39
RECQL P46063 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
SCHEMBL22189174 0.92 ALDH1A1 (0.42) MAPTALDH1A1KDM4EHPGDMAOA
SCHEMBL20181980 0.91 GAA (0.55) MAPTALDH1A1KDM4EHPGDMAOA
SCHEMBL15790419 0.89 EPHX2 (0.53) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL29450789 0.89 EPHX2 (0.53) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL28495469 0.87 ALDH1A1 (0.60) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL20832518 0.87 ALDH1A1 (0.42) MAPTALDH1A1KDM4EHPGDMAOA
SCHEMBL29177959 0.87 MAOA (0.41) MAPTALDH1A1KDM4EHPGDMAOA
SCHEMBL14133142 0.86 GAA (0.59) MAPTALDH1A1KDM4EHPGDMAOA
SCHEMBL19874579 0.84 FABP3 (0.45) MAPTALDH1A1KDM4EHPGDMAOA
SCHEMBL23637428 0.83 GPR3 (0.39) MAPTALDH1A1KDM4EHPGDMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541890-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-10-28 EP disclosed
US-20190352318-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-11-21 US disclosed
WO-2018091435-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-05-24 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-20190352318-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM MAPT 1786/4885ALDH1A1 33/4885KDM4E 3088/4885

“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.