SCHEMBL4420192

SCHEMBL4420192

CC(C)(C)[Si](OCC1(C(O)C(O)C2(CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)CCCC2)CC=CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SMYD2 Q9NRG4 3/20 0.33
TP53 P04637 1/20 0.31
MDM2 Q00987 1/20 0.31
ABL1 P00519 1/20 0.30

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
SCHEMBL13328652 0.81 SMYD2 (0.38) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL4420189 0.79 SMYD2 (0.34) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL4132970 0.76 SMYD2 (0.36) CYP3A4HTTSMN1; SMN2SMYD2ABL1
SCHEMBL4130523 0.76 SMYD2 (0.36) CYP3A4HTTSMN1; SMN2SMYD2ABL1
SCHEMBL22687481 0.75 SMYD2 (0.38) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL10380441 0.75 SMYD2 (0.35) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL2907725 0.75 SMYD2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL13596143 0.75 SMYD2 (0.36) CYP3A4HTTSMN1; SMN2SMYD2ABL1
SCHEMBL4126826 0.74 DGAT1 (0.38) CYP3A4HTTSMN1; SMN2SMYD2ABL1
SCHEMBL8636999 0.73 CYP3A4 (0.34) CYP3A4HTTSMN1; SMN2SMYD2

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-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 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-20090318690-A1 Benzisoxazole Compound NR1I2, NR1I3, NR0B1 CYP3A4 157/4885HTT 3905/4885SMN1; SMN2 3331/4885

“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.