SCHEMBL17686386

SCHEMBL17686386

CC1OCC(CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.46
CYP3A4 P08684 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL17686405 0.79 SMYD2 (0.43) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL5566651 0.76 SMYD2 (0.50) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL5569919 0.76 SMYD2 (0.50) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL15879423 0.76 SMYD2 (0.45) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL15879422 0.76 SMYD2 (0.45) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL15209600 0.73 SMYD2 (0.44) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL15215168 0.73 SMYD2 (0.44) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL599505 0.71 SMYD2 (0.49) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL10172041 0.71 SMYD2 (0.49) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL9661721 0.71 SMYD2 (0.42) SMYD2CYP3A4HTTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160108027-A1 SUBSTITUTED BENZOXAZOLES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-04-21 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-20160108027-A1 SUBSTITUTED BENZOXAZOLES TBXA2R, XDH, CYP4X1 SMYD2 4843/4885CYP3A4 28/4885HTT 2125/4885

“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.