SCHEMBL17811499

SCHEMBL17811499

C=C(c1ccc([Si](C)(C)C)cc1)c1cccc(C(=C)c2ccc([Si](C)(C)C(C)(C)C)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.40
NR1H2 P55055 2/20 0.39
NR1H3 Q13133 2/20 0.39
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35
TUBB2B Q9BVA1 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL17811488 0.88 ACHE (0.43) ACHENR1H2NR1H3TUBB4ATUBB
SCHEMBL17811493 0.83 NR1H2 (0.38) ACHENR1H2NR1H3
SCHEMBL17811498 0.80 ACHE (0.39) ACHENR1H2NR1H3PDE4APDE4B
SCHEMBL17453273 0.77 MEN1 (0.53) ACHENR1H2NR1H3MEN1KMT2A
SCHEMBL19256277 0.75 NR1H2 (0.54) ACHENR1H2NR1H3
SCHEMBL2748306 0.71 KCNK9 (0.47) ACHEMEN1KMT2AMAPT
SCHEMBL8346755 0.70 ACHE (0.51) ACHENR1H2NR1H3MEN1KMT2A
SCHEMBL17811492 0.69 HSD17B14 (0.35) ACHENR1H2NR1H3MEN1KMT2A
SCHEMBL17811495 0.69 NR1H2 (0.38) ACHENR1H2NR1H3MEN1KMT2A
SCHEMBL2749446 0.68 MEN1 (0.45) ACHEMEN1KMT2AMAPTHTT

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-10005869-B2 Polymerisation initiators TRINSEO EUROPE GMBH (CH) 2018-06-26 US disclosed
US-20160159956-A1 Polymerisation Initiators TRINSEO EUROPE GMBH (CH) 2016-06-09 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 (2 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-10005869-B2 Polymerisation initiators ELOVL5, ELOVL3, ELOVL1 ACHE 3731/4885NR1H2 3711/4885NR1H3 3601/4885
US-20160159956-A1 Polymerisation Initiators ELOVL5, ELOVL3, ELOVL1 ACHE 3731/4885NR1H2 3711/4885NR1H3 3601/4885

“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.