SCHEMBL2211524

SCHEMBL2211524

COc1ccc(N2C(=O)C(O[Si](C(C)C)(C(C)C)C(C)C)C2C=C(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 4/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
HSD11B1 P28845 3/20 0.34
HPGD P15428 1/20 0.34
LMNA P02545 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
GFER P55789 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL29531652 0.89 SMN1; SMN2 (0.40) SMN1; SMN2NPSR1RAB9AALDH1A1KDM4E
SCHEMBL4185422 0.87 HSD11B1 (0.38) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL4175719 0.84 NPBWR1 (0.37) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL4175723 0.84 NPBWR1 (0.37) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL8169147 0.83 HSD11B1 (0.36) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL4184940 0.79 NPSR1 (0.39) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL4179397 0.78 HSD11B1 (0.39) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL4179389 0.78 HSD11B1 (0.39) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL4179392 0.78 HSD11B1 (0.39) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A
SCHEMBL5963959 0.76 HSD11B1 (0.39) SMN1; SMN2NPSR1RAB9AALDH1A1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981926-B2 Fluorotaxoids RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2011-07-19 US disclosed
US-20090118355-A1 Fluorotaxoids RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2009-05-07 US disclosed
WO-2008021242-A2 FLUOROTAXOID-FATTY ACID CONJUGATES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2008-02-21 WO disclosed
WO-2007021957-A2 FLUOROTAXOIDS RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2007-02-22 WO 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-20090118355-A1 Fluorotaxoids FAU, ARF5, ARFGEF1 SMN1; SMN2 2582/4885NPSR1 2266/4885RAB9A 927/4885

“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.