SCHEMBL22397155

SCHEMBL22397155

CC(C)(C)[Si](OCC1CC2(CC(CO)C2)C1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.38
CYP3A4 P08684 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ABL1 P00519 1/20 0.31
MGAM O43451 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
SCHEMBL23833335 0.85 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2MGAM
SCHEMBL30078357 0.85 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2MGAM
SCHEMBL23517183 0.85 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2MGAM
SCHEMBL25520744 0.85 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL25520742 0.85 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL22397153 0.84 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL31639722 0.84 BACE1 (0.34) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL30879353 0.82 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2MGAM
SCHEMBL23670835 0.81 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL22070999 0.80 SMYD2 (0.35) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111630051-B Olefin spiro compounds as farnesol X receptor modulators 百时美施贵宝公司 2023-12-26 CN disclosed
EP-3704112-B1 ALKENE SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2023-09-27 EP disclosed
US-11286252-B2 Alkene spirocyclic compounds as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2022-03-29 US disclosed
US-20210179599-A1 ALKENE SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2021-06-17 US disclosed
EP-3704112-A1 ALKENE SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS Bristol-Myers Squibb Company (US) 2020-09-09 EP 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-11286252-B2 Alkene spirocyclic compounds as farnesoid X receptor modulators NR1H2, NR1H4, NR1H3 SMYD2 4385/4885CYP3A4 375/4885HTT 4141/4885
US-20210179599-A1 ALKENE SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS NR1H2, NR1H4, NR1H3 SMYD2 4385/4885CYP3A4 375/4885HTT 4141/4885

“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.