SCHEMBL13719640

SCHEMBL13719640

C=CC(CCCCCCC)[Si](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
SMPD1 P17405 3/20 0.38
FDPS P14324 4/20 0.38
LMNA P02545 1/20 0.37
DNM1 Q05193 2/20 0.36
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
LAP3 P28838 1/20 0.35
THRB P10828 1/20 0.35
OPRM1 P35372 1/20 0.34
GPR84 Q9NQS5 1/20 0.33

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
SCHEMBL31588497 1.00 TSHR (0.39) TSHRSMPD1FDPSLMNADNM1
SCHEMBL3449828 0.81 TSHR (0.38) TSHRFDPSLMNADNM1ADH1B
SCHEMBL964642 0.80 TSHR (0.34) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL959295 0.80 TSHR (0.34) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL1398288 0.79 TSHR (0.33) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL1398299 0.79 TSHR (0.33) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL963368 0.78 TSHR (0.35) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL29243946 0.78 TSHR (0.35) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL961781 0.78 TSHR (0.35) TSHRSMPD1LMNADNM1ADH1B
SCHEMBL28886159 0.78 TSHR (0.35) TSHRSMPD1LMNADNM1ADH1B

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-7572928-B2 Fluorination process ISIS INNOVATION LIMITED (GB) 2009-08-11 US disclosed
US-20070142632-A1 Fluorination process ISIS INNOVATION LIMITED (GB) 2007-06-21 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-20070142632-A1 Fluorination process CYP2F1, SF3A2, SF3B2 TSHR 2174/4885SMPD1 844/4885FDPS 63/4885

“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.