SCHEMBL20539745

SCHEMBL20539745

C[Si]1(C)c2ccccc2Sc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.41
BCHE P06276 6/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
NOX1 Q9Y5S8 3/20 0.39
PTGS1 P23219 3/20 0.39
PTGS2 P35354 3/20 0.39
SLC6A2 P23975 3/20 0.39
ACHE P22303 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
HTR2C P28335 2/20 0.39
SLC6A3 Q01959 2/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
CNR1 P21554 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
SCHEMBL19765339 0.82 RORA (0.33) MAOAMEN1KMT2ASLC6A2ADORA3
SCHEMBL20539129 0.78 BCHE (0.42) MAOABCHEMEN1KMT2ANOX1
SCHEMBL16786730 0.77 ALOX5 (0.33)
SCHEMBL20128378 0.76 RORA (0.36) ACHECYP1A2ALOX12ALDH1A1RORA
Ethane SCHEMBL27766518 0.76
SCHEMBL4571010 0.76 RORA (0.36) ACHECYP1A2ALOX12ALDH1A1RORA
SCHEMBL21629348 0.76 BCHE (0.56) MAOABCHEMEN1KMT2ANOX1
Thianthrene SCHEMBL29392368 0.76 BCHE (0.56) MAOABCHEMEN1KMT2ANOX1
Thianthrene SCHEMBL7786 0.76 BCHE (0.56) MAOABCHEMEN1KMT2ANOX1
SCHEMBL30823 0.76

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-20180309067-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-10-25 US claimed
US-20180309067-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-10-25 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-20180309067-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES ORC3, EZH1, BMI1 MAOA 2319/4885BCHE 2453/4885MEN1 737/4885

“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.