SCHEMBL2297131

SCHEMBL2297131

Cn1c2c(c3ccccc31)C([Si](C)(C)C)c1ccc(F)cc1-2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HCRTR1 O43613 1/20 0.39
WDR5 P61964 1/20 0.39
NTRK1 P04629 3/20 0.35
GPR3 P46089 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34
MAPK14 Q16539 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TERT O14746 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
PDK1 Q15118 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
SCHEMBL12382614 1.00 ATM (0.42) ATMMEN1KMT2AHCRTR1WDR5
SCHEMBL12382620 0.85 ATM (0.32) ATMMEN1KMT2AHCRTR1NTRK1
SCHEMBL12382603 0.85 ATM (0.42) ATMMEN1KMT2AHCRTR1WDR5
SCHEMBL2294983 0.85 ATM (0.42) ATMMEN1KMT2AHCRTR1WDR5
SCHEMBL12382609 0.82 NTRK1 (0.48) MEN1KMT2ANTRK1ALDH1A1HTT
SCHEMBL2295261 0.82 NTRK1 (0.48) MEN1KMT2ANTRK1ALDH1A1HTT
SCHEMBL12422981 0.82 MAOA (0.37) NTRK1ALDH1A1MAPTKDM4EHPGD
SCHEMBL2295960 0.82 MAOA (0.37) NTRK1ALDH1A1MAPTKDM4EHPGD
SCHEMBL7118279 0.75 NTRK1 (0.40) WDR5NTRK1GPR3ALDH1A1MAPT
SCHEMBL7128822 0.73 NTRK1 (0.38) WDR5NTRK1GPR3ALDH1A1MAPT

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-8703936-B2 Compositions and methods for modification of biomolecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-04-22 US disclosed
US-20140045207-A1 COMPOSITIONS AND METHODS FOR MODIFICATION OF BIOMOLECULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-13 US disclosed
US-8519122-B2 Compositions and methods for modification of biomolecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-08-27 US disclosed
US-20110207147-A1 Compositions and Methods for Modification of Biomolecules NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-08-25 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-20110207147-A1 Compositions and Methods for Modification of Biomolecules PTMS, APEX1, ALG1 ATM 918/4885MEN1 2863/4885KMT2A 2800/4885

“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.