SCHEMBL9951152

SCHEMBL9951152

CCn1cc(/C=C/C2(c3ccccc3)CC2CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)cn1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
SMYD2 Q9NRG4 2/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL9951154 1.00 CYP3A4 (0.33) CYP3A4HTTSMN1; SMN2HDAC1HDAC2
SCHEMBL9951251 0.80 HDAC2 (0.40) SMN1; SMN2HDAC1HDAC2ALDH1A1KDM4E
SCHEMBL10188800 0.79 SMYD2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9950613 0.77 CYP1A1 (0.40) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL9950610 0.77 CYP1A1 (0.40) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL9950042 0.77 CYP3A4 (0.36) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9950045 0.77 CYP3A4 (0.36) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL2117758 0.75 CYP3A4 (0.40) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9950850 0.75 CYP3A4 (0.40) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9950541 0.74 L3MBTL1 (0.43) CYP3A4HTTSMN1; SMN2SMYD2LMNA

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-20120165339-A1 CYCLOPROPANE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-28 US disclosed
US-20120165339-A1 CYCLOPROPANE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-28 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-20120165339-A1 CYCLOPROPANE DERIVATIVES HCRTR2, HCRTR1, CNR1 CYP3A4 2390/4885HTT 1672/4885SMN1; SMN2 592/4885

“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.