SCHEMBL21766544

SCHEMBL21766544

c1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3ccccc3Nc3cccc4c3oc3ccccc34)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
PTGES2 Q9H7Z7 1/20 0.42
GGPS1 O95749 1/20 0.38
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CSF1R P07333 1/20 0.34
PDGFRB P09619 1/20 0.34
KIT P10721 1/20 0.34
FLT3 P36888 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
PRKDC P78527 4/20 0.33
MYC P01106 1/20 0.33
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33
PRMT5 O14744 1/20 0.33

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
SCHEMBL21766564 0.90 ALOX5 (0.42) ALOX5PTGES2GGPS1ALDH1A1LMNA
SCHEMBL13681137 0.86 ALOX5 (0.57) ALOX5PTGES2GGPS1ALDH1A1SMN1; SMN2
SCHEMBL4080117 0.86 ALOX5 (0.46) ALOX5PTGES2GGPS1ALDH1A1LMNA
SCHEMBL24604379 0.83 ALOX5 (0.51) ALOX5PTGES2GGPS1SMN1; SMN2MAPT
SCHEMBL13681141 0.83 ALOX5 (0.55) ALOX5PTGES2GGPS1SMN1; SMN2MAPT
SCHEMBL21766578 0.81 ALOX5 (0.37) ALOX5PTGES2ALDH1A1LMNASMN1; SMN2
SCHEMBL21766547 0.81 PTGES2 (0.52) ALOX5PTGES2GGPS1ALDH1A1LMNA
SCHEMBL14948265 0.80 ALOX5 (0.51) ALOX5PTGES2GGPS1ALDH1A1SMN1; SMN2
SCHEMBL14058202 0.79 ALOX5 (0.50) ALOX5PTGES2GGPS1SMN1; SMN2MAPT
SCHEMBL13681150 0.79 ALOX5 (0.52) ALOX5PTGES2GGPS1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200313099-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Element Using Same, and Manufacturing Method Therefor LG CHEM, LTD. (KR) 2020-10-01 US disclosed
WO-2020040585-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING ELEMENT USING SAME, AND MANUFACTURING METHOD THEREFOR 주식회사 엘지화학 2020-02-27 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-20200313099-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Element Using Same, and Manufacturing Method Therefor SEM1, NOTUM, ORMDL3 ALOX5 295/4885PTGES2 1887/4885GGPS1 89/4885

“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.